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Shanghai APIs Chemical Co., Ltd.

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Profile: Shanghai APIs Chemical Co., Ltd. is specializes in manufacturer of API chemicals to various chemical induistries.

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• 4-Chloro-7-azaindole
IUPAC Name: 4-chloro-1H-pyrrolo[2,3-b]pyridine | CAS Registry Number: 55052-28-3
Synonyms: 4-CHLORO-7-AZAINDOLE, 4-chloro-1H-pyrrolo[2,3-b]pyridine, AG-F-92201, 1H-PYRROLO[2,3-B]PYRIDINE, 4-CHLORO-, AN-584/43416898, PubChem17277, AC1Q3HXF, AC1Q3HXG, ACMC-1AY8O, SureCN100651, 4-CHLORO-7-AZAINDOL, KSC494A8L, AGN-PC-0084ST, 4-chloropyrrolo[2,3-b]pyridine, CTK3J4085, HIN1337, MolPort-001-758-292, ACN-S002668, ACT03614, 4-chlor-1H-pyrrolo[2,3-b]pyridin

Molecular Formula: C7H5ClN2Molecular Weight: 152.581000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: HNTZVGMWXCFCTA-UHFFFAOYSA-N

• (S)-(-)-3-Butyn-2-Ol
IUPAC Name: (2S)-but-3-yn-2-ol | CAS Registry Number: 2914-69-4
Synonyms: 1-Methylpropargyl alcohol, 464007_ALDRICH, (S)-(-)-3-Butyn-2-ol, ZINC01756137, CID6995470

Molecular Formula: C4H6OMolecular Weight: 70.089840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: GKPOMITUDGXOSB-BYPYZUCNSA-N

• 1-Boc-Octahydropyrrolo[3,4-B]pyridine
IUPAC Name: tert-butyl (4aR,7aS)-2,3,4,4a,5,6,7,7a-octahydropyrrolo[3,4-b]pyridin-6-ium-1-carboxylate | CAS Registry Number: 159877-36-8
Synonyms: ZINC04203951

Molecular Formula: C12H23N2O2+Molecular Weight: 227.323220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LGEWGFOMLJQHLL-NXEZZACHSA-O

• 5-Boc-Octahydro-Pyrrolo[3,4-C]pyridine
IUPAC Name: tert-butyl (3aS,7aR)-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridin-2-ium-5-carboxylate | CAS Registry Number: 351370-99-5
Synonyms: ZINC04203955

Molecular Formula: C12H23N2O2+Molecular Weight: 227.323220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LRTPRHCNWAEZBN-UWVGGRQHSA-O

• 2-Azetidinecarboxylic acid methyl ester
IUPAC Name: methyl azetidine-2-carboxylate | CAS Registry Number: 134419-57-1
Synonyms: methyl azetidine-2-carboxylate, METHYL 2-AZETIDINECARBOXYLATE, Azetidine-2-carboxylic acid methyl ester, Azetidine-2-carboxylicacidmethylester, AG-D-70182, 2-Azetidinecarboxylicacid, methyl ester, PubChem23978, ACMC-20a6q2, AGN-PC-00LOF0, SureCN2065284, Methyl2-azetidinecarboxylate;, CTK4B9158, MolPort-000-000-966, ANW-59640, AKOS006277411, MB03946, DL-METHYL 2-AZETIDINECARBOXYLATE, 2-Azetidinecarboxylic acid, methyl ester, AK-44269, KB-47480

Molecular Formula: C5H9NO2Molecular Weight: 115.130460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CHNOQXRIMCFHKZ-UHFFFAOYSA-N

• 1H-PYRROLE-2,3,5-TRICARBOXYLIC ACID,4-METHYL-,3,5-DIETHYL ESTER
IUPAC Name: 3,5-bis(ethoxycarbonyl)-4-methyl-1H-pyrrole-2-carboxylic acid | CAS Registry Number: 37789-75-6
Synonyms: Oprea1_170448, NSC26687, MolPort-003-806-045, CID231108, AI-942/13331751

Molecular Formula: C12H15NO6Molecular Weight: 269.250600 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: GLIIUALSMNDSMN-UHFFFAOYSA-N

• 2-(TRIFLUOROMETHYL)-[1,2,4]TRIAZOLO[1,5-A]PYRAZINE,95+%
IUPAC Name: 2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrazine | CAS Registry Number: 681249-56-9
Synonyms: 2-(Trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrazine, SureCN1620961, AKOS006328750, AB52993, AK-24651, I14-17069

Molecular Formula: C6H3F3N4Molecular Weight: 188.110030 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: PODZNIVAQJSKBB-UHFFFAOYSA-N

• 2-(4-Bromophenyl)-1-(2,4-Dihydroxyphenyl)ethanone
IUPAC Name: 2-(4-bromophenyl)-1-(2,4-dihydroxyphenyl)ethanone | CAS Registry Number: 92152-60-8
Synonyms: 2-(4-bromophenyl)-1-(2,4-dihydroxyphenyl)ethanone, 1-(2,4-dihydroxyphenyl)-2-(4-bromophenyl)ethan-1-one, ZINC02566403, SureCN2331741, Oprea1_260410, MLS000113451, AC1M14F0, STOCK3S-00765, CTK5H0948, MolPort-000-424-536, HMS2185H11, ANW-46395, SBB081001, STK841186, AKOS000275901, AG-H-78150, MCULE-5482915082, AK-86252, SMR000109349, KB-222370

Molecular Formula: C14H11BrO3Molecular Weight: 307.139340 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: GVDMPWQNNRNDOG-UHFFFAOYSA-N

• 1-Bromo-2-methoxy-3-nitrobenzene
IUPAC Name: 1-bromo-2-methoxy-3-nitrobenzene | CAS Registry Number: 98775-19-0
Synonyms: 1-bromo-2-methoxy-3-nitrobenzene, 1-BROMO-2-METHOXY-3-NITRO-BENZENE, 2-Bromo-6-nitroanisole, AN-584/43409814, PubChem16795, ACMC-1AIDP, 2-bromo-6-nitro-anisole, SureCN1707141, KSC496G1R, 3-Bromo-2-methoxynitrobenzene, BEN750, CTK3J6318, MolPort-005-943-612, 3-bromo-2-methoxy-1-nitrobenzene, ANW-40959, SBB097845, ZINC19872893, 1-bromanyl-2-methoxy-3-nitro-benzene, AKOS015851656, AKOS015912523

Molecular Formula: C7H6BrNO3Molecular Weight: 232.031440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: YAYBLVOBUIXMQY-UHFFFAOYSA-N

• 4-(DIFLUOROMETHOXY)-3-(CYCLOPROPYLMETHOXY)-BENZALDEHYDE
IUPAC Name: 3-(cyclopropylmethoxy)-4-(difluoromethoxy)benzaldehyde | CAS Registry Number: 151103-09-2
Synonyms: 4-(DIFLUOROMETHOXY)-3-(CYCLOPROPYLMETHOXY)BENZALDEHYDE, 4-(Difluoromethoxy)-3-(cyclopropylmethoxy)-benzaldehyde, 3-(cyclopropylmethoxy)-4-(difluoromethoxy)benzaldehyde, Benzaldehyde,3-(cyclopropylmethoxy)-4-(difluoromethoxy)-, ACMC-209v7w, KSC526Q8T, CTK4C6889, ANW-44730, AKOS015891175, AG-D-97939, AM84469, QC-1332, RP28516, AK-47888, KB-27532, FT-0660889, X3187, A24676, 3-Cyclopropylmethoxy-4-difluoromethoxybenzaldehyde;, I01-9125

Molecular Formula: C12H12F2O3Molecular Weight: 242.218686 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: AHVVCELVGCPYGI-UHFFFAOYSA-N

• 1-Pyrrolidinecarboxylic Acid, 3-Amino-4-Hydroxy-, 1,1-Dimethylethyl Ester, (3R,4R)-Rel-
IUPAC Name: [(3R,4R)-4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]azanium | CAS Registry Number: 148214-90-8
Synonyms: ZINC04203559

Molecular Formula: C9H19N2O3+Molecular Weight: 203.258760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: MOZOQDNRVPHFOO-RNFRBKRXSA-O

• (s)-3-Aminotetrahydrofuran
IUPAC Name: (3S)-oxolan-3-amine | CAS Registry Number: 104530-79-2
Synonyms: (S)-tetrahydrofuran-3-amine, (S)-3-Aminotetrahydrofuran, (3S)OXOLANE-3-YLAMINE, AG-D-16856, 3-Furanamine,tetrahydro-, (3S)-, SureCN429737, (3S)-OXOLAN-3-AMINE, CTK4A3103, MolPort-005-937-196, ACT06806, ANW-49392, AKOS015854192, AG-E-49964, PB18852, (S)-TETRAHYDRO-FURAN-3-YLAMINE, AC-18217, AK-75870, BP-11345, BR-75870, 3-FURANAMINE, TETRAHYDRO-, (3S)-

Molecular Formula: C4H9NOMolecular Weight: 87.120360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MIPHRQMEIYLZFZ-BYPYZUCNSA-N

• 2-Amino-6-Bromophenol
IUPAC Name: 2-amino-6-bromophenol | CAS Registry Number: 28165-50-6
Synonyms: 2-Amino-6-bromophenol, FR-2404, TL8002241

Molecular Formula: C6H6BrNOMolecular Weight: 188.021940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: LOBRHADLNRMHOO-UHFFFAOYSA-N

• (3aR,7aS)-tert-Butyl 5-oxooctahydro-1H-indole-1-carboxylate
IUPAC Name: tert-butyl (3aR,7aS)-5-oxo-3,3a,4,6,7,7a-hexahydro-2H-indole-1-carboxylate | CAS Registry Number: 1260595-26-3
Synonyms: 143268-07-9, MolPort-023-330-978, AKOS016002067, AK-76856, AK-76857, AJ-111813, tert-butyl (3aR,7aS)-5-oxooctahydro-1H-indole-1-carboxylate, (3aR,7aS)-rel-tert-Butyl 5-oxooctahydro-1H-indole-1-carboxylate

Molecular Formula: C13H21NO3Molecular Weight: 239.310740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: FAFPNFIAMGOSNB-KOLCDFICSA-N

• 1-2(-Hydroxy Ethyl) Piperazine
IUPAC Name: 2-piperazin-1-ylethanol | CAS Registry Number: 103-76-4
Synonyms: 2-Piperazinoethanol, 1-Piperazinethanol, Hydroxyethylpiperazine, 1-PIPERAZINEETHANOL, 2-Hydroxyethylpiperazine, 2-Piperazin-1-ylethanol, 1-(2-Hydroxyethyl)piperazine, Piperazine-1-ethanol, 2-(1-Piperazinyl)ethanol, USAF DO-22, N-(2-Hydroxyethyl)piperazine, 4-(2-Hydroxyethyl)piperazine, Ethanol, 2-(1-piperazinyl)-, (.beta.-Hydroxyethyl)piperazine, N-(Hydroxyethyl)piperazine, CCRIS 6687, N-(beta-Hydroxyethyl)piperazine, 1-(beta-Hydroxyethyl)piperazine, H28807_ALDRICH, WLN: T6M DNTJ D2Q

Molecular Formula: C6H14N2OMolecular Weight: 130.188160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WFCSWCVEJLETKA-UHFFFAOYSA-N

• (R)-(+)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl [(R)-BINAP]
IUPAC Name: [1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane | CAS Registry Number: 76189-55-4
Synonyms: (R)-(+)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, 98327-87-8, 2,2'-BIS(DIPHENYLPHOSPHINO)-1,1'-BINAPHTHYL, (R)-(+)-BINAP, (S)-(-)-BINAP, 76189-56-5, (+/-)-BINAP, rac-BINAP, BINAP, (S)-(-)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, (+/-)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, (S)-BINAP, (R)-2,2'-bis(Diphenylphosphino)-1,1'-binaphthyl, (S)-(+)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, (S)-(-)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthalene, (S)-(-)-2,2'-Bis(diphenylphosphosino)-1,1'-binaphthyl, 2,2'-Bis(diphenylphosphino)-1,1'-binaphthalene, 2,2'-Bis-diphenylphosphanyl-[1,1']binaphthalenyl, (+/-)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthalene, (R)-(+)-2,2'-Bis(diphenylphosphino)-1'1-binaphthyl

Molecular Formula: C44H32P2Molecular Weight: 622.672404 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: MUALRAIOVNYAIW-UHFFFAOYSA-N

• 1-(1,1-DIOXIDOTETRAHYDRO-2H-THIOPYRAN-4-YL)METHANAMINE, 95%
IUPAC Name: (1,1-dioxothian-4-yl)methanamine | CAS Registry Number: 476660-77-2
Synonyms: Ambcb4018202, SureCN4875595, MolPort-013-118-762, (1,1-Dioxothian-4-yl)methanamine, AKOS005264588, MCULE-6439992039, RP08633, 4-(aminomethyl)-1$l^{6}-thiane-1,1-dione, C-8395, [(1, 1-DIOXOTETRAHYDRO-2H-THIOPYRAN-4-YL)METHYL]AMINE

Molecular Formula: C6H13NO2SMolecular Weight: 163.237920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: PYWSWTFWUWSPKT-UHFFFAOYSA-N

• 3- Benzofuranacetic acid, 2,3-dihydro-6-hydroxy-, methyl ester
IUPAC Name: methyl 2-(6-hydroxy-2,3-dihydro-1-benzofuran-3-yl)acetate | CAS Registry Number: 805250-17-3
Synonyms: Methyl 2-(6-hydroxy-2,3-dihydrobenzofuran-3-yl)acetate, SureCN435248, CTK8C0134, MolPort-020-233-866, ANW-64216, AKOS015919522, QC-3572, AK-48513, BR-48513, KB-78456, W8545

Molecular Formula: C11H12O4Molecular Weight: 208.210580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: RHMDISFJOKCCAQ-UHFFFAOYSA-N

• (1R,2R)-2-(3,4-difluorophenyl)cyclopropanamine(S)-(carboxylato(phenyl)methyl)holmium
IUPAC Name: (1R,2S)-2-(3,4-difluorophenyl)cyclopropan-1-amine;(2R)-2-hydroxy-2-phenylacetic acid | CAS Registry Number: 376608-71-8
Synonyms: AMX10102, EX-7182, (1R,2S)-2-(3,4-difluorophenyl)cyclopropanamine D-Mandelic acid, (1R,2R)-2-(3,4-difluorophenyl)cyclopropanamine(S)-(carboxylato(phenyl)methyl), (1R,2S)-2-(3,4-Difluorophenyl)cyclopropanamine (2R)-Hydroxy(phenyl)ethanoate, (|AR)-|A-Hydroxybenzeneacetic Acid compd. with (1R,2S)-2-(3,4-Difluorophenyl)cyclopropanamine

Molecular Formula: C17H17F2NO3Molecular Weight: 321.318586 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: GUESUQPLVFMJIT-KLTOLQSASA-N

• 3,4-Methylenedioxyphenylboronic Acid (CAS: 94839-04-3)
• (1S,4R)-methyl-4-aminocyclopent-2-enecarboxylate L-tartaric acid
IUPAC Name: (2R,3R)-2,3-dihydroxybutanedioic acid;methyl (1S,4R)-4-aminocyclopent-2-ene-1-carboxylate | CAS Registry Number: 419563-22-7
Synonyms: (1S,4R)-Methyl 4-aminocyclopent-2-enecarboxylate (2R,3R)-2,3-dihydroxysuccinate, SureCN7521128, MolPort-021-784-672, AKOS015924510, AK122878, KB-205452, B-2116, (1S,4R)-methyl 4-aminocyclopent-2-enecarboxylate L-tartrate salt

Molecular Formula: C11H17NO8Molecular Weight: 291.254580 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 9

InChIKey: XSEHIOOHMZAFCV-IBSOYGIKSA-N

• (3aR,6aS)-1-(tert-butoxycarbonyl)octahydrocyclopenta[c]pyrrol-2-ium carboxyfor
IUPAC Name: tert-butyl (3S,3aS,6aR)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxylate;oxalic acid | CAS Registry Number: 907606-68-2
Synonyms: (1S,3aR,6aS)-tert-Butyl octahydrocyclopenta[c]pyrrole-1-carboxylate oxalate, SureCN1569384, CTK8C5244, ANW-74900, AKOS016000239, AK-87947, KB-205428

Molecular Formula: C14H23NO6Molecular Weight: 301.335520 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: ZCTXDLWZMFBZEV-PUBMXKGKSA-N

• 2-METHOXY-5-[(Z)-2-(3,4,5-TRIMETHOXYPHENYL)VINYL]PHENOXY]PHOSPHONIC ACID
IUPAC Name: disodium [2-methoxy-5-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl] phosphate | CAS Registry Number: 222030-63-9
Synonyms: Zybrestat, Fosbretabulin, Fosbretabulin disodium, CA4DP, CA4P, Combretastatin A-4 phosphate, Fosbretabulin disodium (USAN), CHEBI:152812, MolPort-006-823-175, CID6918309, D09346, 2-Methoxy-5-((1Z)-2-(3,4,5-trimethoxyphenyl)ethenyl)phenyl phosphate, disodium mono(Z)-5-(3,4,5-trimethoxystyryl)-2-methoxyphenyl phosphate, disodium 2-methoxy-5-[(Z)-2-(3,4,5-trimethoxyphenyl)vinyl]phenyl phosphate, Phenol, 2-methoxy-5-((1Z)-2-(3,4,5-trimethoxyphenyl)ethenyl)-, dihydrogen phosphate, Di-Sodium salt of Phosphoric acid mono-{2-methoxy-5-[2-(3,4,5-trimethoxy-phenyl)-vinyl]-phenyl} ester, Disodium Phosphoric acid mono-{2-methoxy-5-[2-(3,4,5-trimethoxy-phenyl)-vinyl]-phenyl} ester, Phosphoric acid mono-{2-methoxy-5-[(Z)-2-(3,4,5-trimethoxy-phenyl)-vinyl]-phenyl} ester; disodium salt

Molecular Formula: C18H19Na2O8PMolecular Weight: 440.291961 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 8

InChIKey: VXNQMUVMEIGUJW-XNOMRPDFSA-L

• (S)-Tetrahydro-2H-pyran-3-amine
IUPAC Name: (3S)-oxan-3-amine;hydrochloride | CAS Registry Number: 1071829-81-6
Synonyms: (S)-tetrahydro-2H-pyran-3-amine hydrochloride, 1245724-46-2, PubChem19623, PubChem22290, SureCN2224224, CTK8C4329, MolPort-020-233-926, ANW-71578, AK-77753, KB-05701, X6276, (S)-TETRAHYDRO-2H-PYRAN-3-AMINE HCL

Molecular Formula: C5H12ClNOMolecular Weight: 137.607880 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: RETPVBQTPDYSBS-JEDNCBNOSA-N

• (1R,2R)-2-(3,4-difluorophenyl)cyclopropane carboxamide
IUPAC Name: (1R,2R)-2-(3,4-difluorophenyl)cyclopropane-1-carboxamide | CAS Registry Number: 1006376-62-0
Synonyms: (1R,2R)-2-(3,4-Difluorophenyl)cyclopropanecarboxamide, SureCN2397845, AKOS016014032, AK130288, KB-205290

Molecular Formula: C10H9F2NOMolecular Weight: 197.181366 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: PYEJQVYISBUGDU-NKWVEPMBSA-N

• 9-(1H-benzimidazol-2-ylsulfinyl)-6,7,8,9-tetrahydro-4-methoxy- 5H-Cyclohepta[b]pyridine
IUPAC Name: 9-(1H-benzimidazol-2-ylsulfinyl)-4-methoxy-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine | CAS Registry Number: 136177-53-2
Synonyms: Nepaprazole, 9-(1H-benzimidazol-2-ylsulfinyl)-4-methoxy-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine, Nepaprazole [INN], AC1MJ6LN, DSSTox_CID_31442, DSSTox_RID_97328, DSSTox_GSID_57653, SCHEMBL635636, CHEMBL2107217, Tox21_113728, NCGC00253591-01, SC-21418, DB-063121, CAS-156601-79-5, 9-(1H-benzimidazol-2-ylsulfinyl)-6,7,8,9-tetrahydro-4-methoxy-5H-Cyclohepta[b]pyridine, (+-)-(9R*)-9-((SS*)-2-Benzimidazolylsulfinyl)-6,7,8,9-tetrahydro-4-methoxy-5H-cyclohepta(b)pyridine, (- )-(9R*)-9-((SS*)-2-Benzimidazolylsulfinyl)-6,7,8,9-tetrahydro-4-methoxy-5H-cyclohepta(b)pyridine., 156601-79-5, 9-((1H-benzo[d]imidazol-2-yl)sulfinyl)-4-methoxy-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine, 9-(1H-benzo[d]imidazol-2-ylsulfinyl)-4-methoxy-6,7,8,9-tetrahydro-5h-cyclohepta[b]pyridine

Molecular Formula: C18H19N3O2SMolecular Weight: 341.427360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: JWMQOWBYKLZSPY-UHFFFAOYSA-N

• 2-[[2-[[4-[4-[[4-(1,1-dimethylethyl)phenyl]amino]phenoxy]-6-methoxy-7-quinolinyl]oxy]ethyl]amino]Ethanol
IUPAC Name: 2-[2-[4-[4-(4-tert-butylanilino)phenoxy]-6-methoxyquinolin-7-yl]oxyethylamino]ethanol | CAS Registry Number: 516523-31-2
Synonyms: CHEMBL352308, SCHEMBL1249550, KI23057, 2-((2-((4-(4-((4-(tert-butyl)phenyl)amino)phenoxy)-6-methoxyquinolin-7-yl)oxy)ethyl)amino)ethan-1-ol

Molecular Formula: C30H35N3O4Molecular Weight: 501.616600 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: VQCDZFWRGXFUMS-UHFFFAOYSA-N

• 6-Amino-2-azaspiro[3.3]heptane-6-carboxylic acid 2HCl
IUPAC Name: 6-amino-2-azaspiro[3.3]heptane-6-carboxylic acid;hydrochloride | CAS Registry Number: 1170461-72-9
Synonyms: AKOS015950347, RP08894, 6-Amino-2-azaspiro[3.3]heptane-6-carboxylic acid HCl

Molecular Formula: C7H13ClN2O2Molecular Weight: 192.643320 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: JCUAEGWQXRGVCS-UHFFFAOYSA-N

• (+)-B-Chlorodiisopinocamphenylborane
IUPAC Name: chloro-[(4R,5S)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]-[(4S,5R)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]borane | CAS Registry Number: 112246-73-8
Synonyms: AB1011211

Molecular Formula: C20H34BClMolecular Weight: 320.747960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: PSEHHVRCDVOTID-NSJQXPOASA-N

• 6,7-Dihydro-6-mercapto-5H-pyrazolo[1,2-a][1,2,4]triazolium chloride
IUPAC Name: 6,7-dihydro-5H-pyrazolo[1,2-a][1,2,4]triazol-4-ium-6-thiol;chloride | CAS Registry Number: 153851-71-9
Synonyms: 6,7-Dihydro-6-mercapto-5h-pyrazolo[1,2-a][1,2,4]triazol-4-ium chloride, 5H-Pyrazolo[1,2-a][1,2,4]triazol-4-ium, 6,7-dihydro-6-mercapto-, chloride, Side chain for biapenem, MolPort-003-986-473, ANW-73895, SBB066376, AKOS006284722, AC-2026, RP17817, AK-47895, L840, TL8001153, M-2663, I09-0251, 6,7-dihydro-6-mercapto-5H-pyrazolo[1,2-a][1,2,4]triazolium chloride; 6,7-dihydro-6-mercapto-5H-pyrazolo[1,2-a][1,2,4]triazol-4-ium,c hloride

Molecular Formula: C5H8ClN3SMolecular Weight: 177.655120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: HPBXUFOSZBCEIQ-UHFFFAOYSA-N

• 2-Bromo-4-(trifluoromethyl)pyridine
IUPAC Name: 2-bromo-4-(trifluoromethyl)pyridine | CAS Registry Number: 175205-81-9
Synonyms: 2-bromo-4-trifluoromethylpyridine, 2-bromo-4-trifluoromethyl-pyridine, SBB054274, AG-E-25482, ZINC02526213, PubChem8064, AC1MD0AA, ACMC-209e9d, 661139_ALDRICH, CTK3J5735, MolPort-000-152-467, 2-Bromo-4-trifluoromethylpyridine;, ACT06705, ANW-22751, AKOS005145687, AB04062, MCULE-6094578841, AK-33721, KB-21238, 2-BROMO-4-(TRIFLUORMETHYL)PYRIDINE

Molecular Formula: C6H3BrF3NMolecular Weight: 225.993930 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: WZVHLUMAQLUNTJ-UHFFFAOYSA-N

• 2,6-diaza-spiro[3.5]nonane-2-carboxylic Acid Tert-butyl Ester
IUPAC Name: tert-butyl 2,6-diazaspiro[3.5]nonane-6-carboxylate | CAS Registry Number: 885272-17-3
Synonyms: tert-butyl 2,6-diazaspiro[3.5]nonane-6-carboxylate, AG-H-56998, tert-butyl2,6-diazaspiro[3.5]nonane-6-carboxylate, 2,6-Diazaspiro[3.5]nonane-6-carboxylic acid tert-butyl ester, SureCN2177880, CTK5G0261, MolPort-003-987-372, BH252, ACT08861, 6-Boc-2,6-diazaspiro[3.5]nonane, ANW-48653, FC0228, WT1174, AKOS005146389, QC-9819, RP07609, AK-24005, BR-24005, KB-80867, TL8005736

Molecular Formula: C12H22N2O2Molecular Weight: 226.315280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: KQPABIHNWDOPIY-UHFFFAOYSA-N

• 6,7-dihydro-5h-pyrrolo(3,4-b)pyridine 2hcl
IUPAC Name: 6,7-dihydro-5H-pyrrolo[3,4-b]pyridine | CAS Registry Number: 147739-88-6
Synonyms: 6,7-dihydro-5H-pyrrolo[3,4-b]pyridine, 6,7-Dihydro-5H-pyrrolo3,4-bpyridine, 5H,6H,7H-pyrrolo[3,4-b]pyridine, PubChem11371, SureCN103669, SureCN207746, AC1LU33P, CTK5J7508, MolPort-000-140-424, ANW-46627, AKOS006283538, AC-2807, AG-A-87909, PB30869, QC-3306, RP19379, EN000658, KB-44483, 6,7-Dihydro-5H-pyrrolo[3,4,6]pyridine, AB1001493

Molecular Formula: C7H8N2Molecular Weight: 120.151820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: SJMNQXLXIIXDDS-UHFFFAOYSA-N

• (R)-1-Boc-3-hydroxymethyl-piperazine
IUPAC Name: tert-butyl (3R)-3-(hydroxymethyl)piperazine-1-carboxylate | CAS Registry Number: 278788-66-2
Synonyms: (R)-4-N-Boc-2-hydroxymethyl-piperazine, (r)-1-boc-3-(hydroxymethyl)piperazine, (R)-3-Hydroxymethyl-piperazine-1-carboxylic acid tert-butyl ester, (R)-1-Boc-3-hydroxymethylpiperazine, (r)-tert-butyl 3-(hydroxymethyl)piperazine-1-carboxylate, (R)-4-Boc-2-hydroxymethyl-piperazine, AG-E-89051, (r)-1-n-boc-3-hydroxymethyl-piperazine, tert-butyl (3R)-3-(hydroxymethyl)piperazine-1-carboxylate, PubChem23943, SureCN994990, (R)-3-Hydroxymethyl-piperazine-1-carboxylicacidtert-butylester, KSC496K6J, Jsp005386, CTK3J6564, MolPort-000-004-176, PS-J-055, ANW-52375, RW3043, ZINC54959966

Molecular Formula: C10H20N2O3Molecular Weight: 216.277400 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: NSILYQWHARROMG-MRVPVSSYSA-N

• 6H-Purin-6-one, 2-amino-1,9-dihydro-9-[(1S,3R,4S)-2-methylene-4-(phenylmethoxy)-3-[(phenylmethoxy)methyl]cyclopentyl]-
IUPAC Name: 2-amino-9-[(1S,3R,4R)-2-methylidene-4-phenylmethoxy-3-(phenylmethoxymethyl)cyclopentyl]-3H-purin-6-one | CAS Registry Number: 142217-81-0
Synonyms: 3',5'-Di-O-benzyl Entecavir, [1S-(1|A,3|A,4|A)]-2-Amino-1,9-dihydro-9-[2-methylene-4-(phenylmethoxy)-3-[(phenylmethoxy)methyl]cyclopentyl]-6H-purin-6-one, 2-Amino-1,9-dihydro-9-[(1S,3R,4S)-2-methylene-4-(phenylmethoxy)-3-[(phenylmethoxy)methyl]cyclopentyl]-6H-purin-6-one

Molecular Formula: C26H27N5O3Molecular Weight: 457.524280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: KROVOOOAPHSWCR-FDFHNCONSA-N

• 9H-Purin-2-amine, N-[(4-methoxyphenyl)diphenylmethyl]-9-[2-methylene-4-(phenylmethoxy)-3-[(phenylmethoxy)methyl]cyclopentyl]-6-(phenylmethoxy)-, [1S-(1a,3a,4b)]-
IUPAC Name: N-[(4-methoxyphenyl)-diphenylmethyl]-9-[(1S,3S)-2-methylidene-4-phenylmethoxy-3-(phenylmethoxymethyl)cyclopentyl]-6-phenylmethoxypurin-2-amine | CAS Registry Number: 142217-80-9
Synonyms: 6-(Benzyloxy)-9-((1S,3S)-4-(benzyloxy)-3-((benzyloxy)methyl)-2-methylenecyclopentyl)-N-((4-methoxyphenyl)diphenylmethyl)-9H-purin-2-amine, CTK8B4393, ANW-44903, AKOS015896665, AK-72844, BR-72844, I06-2209, 6-(Benzyloxy)-9-((1S,3S)-4-(benzyloxy)-3-((benzyloxy)methyl)-2-methylenecyclopentyl)-N-((4-methoxyph

Molecular Formula: C53H49N5O4Molecular Weight: 819.987260 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 8

InChIKey: OXHGMTPGAFKZHK-SHRDPCBYSA-N

• 5,6-Diethyl-2,3-dihydro-1H-inden-2-amine hydrochloride
IUPAC Name: 5,6-diethyl-2,3-dihydro-1H-inden-2-amine;hydrochloride | CAS Registry Number: 312753-53-0
Synonyms: 5,6-diethyl-2,3-dihydro-1H-inden-2-amine Hydrochloride, 5,6-diethylindan-1-one, SureCN866127, CTK8B4378, MolPort-021-784-844, ANW-44874, AKOS015924667, LS40648, RP27622, AK-79681, BD227882, KB-196291, FT-0686954, X6200, 2-AMINO-5,6-DIETHYL-2,3-DIHYDRO-1H-INDENE HCL

Molecular Formula: C13H20ClNMolecular Weight: 225.757600 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: ZOVIYWYFBOQKIA-UHFFFAOYSA-N

• 2-Aminomethyl-4-Boc-Morpholine
IUPAC Name: [(2S)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholin-2-yl]methylazanium | CAS Registry Number: 140645-53-0
Synonyms: ZINC04203216

Molecular Formula: C10H21N2O3+Molecular Weight: 217.285340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MTMBHUYOIZWQAJ-QMMMGPOBSA-O

• 7-[Trans-3-(1-Azetidinylmethyl)cyclobutyl]-5-[3-(phenylmethoxy)phenyl]-7H-Pyrrolo[2,3-D]pyrimidin-4-Amine
IUPAC Name: 7-[3-(azetidin-1-ylmethyl)cyclobutyl]-5-(3-phenylmethoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-amine | CAS Registry Number: 475488-34-7
Synonyms: NVP-AEW541, AEW-541, AEW541, AEW 541, 475489-16-8, SureCN94862, AGN-PC-009VBF, SureCN1441421, SureCN1987652, NVP AEW541, cc-535, NVP-AEW 541, UNII-97QB5037VR, CTK4J0098, BCPP000146, DCL000364, AG-F-61825, BCP9001006, CS-0448, PB19343

Molecular Formula: C27H29N5OMolecular Weight: 439.552060 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: AECDBHGVIIRMOI-UHFFFAOYSA-N

• 2-(8-HYDROXY-6-METHOXY-1-OXO-1H-ISOCHROMEN-3-YL)PROPANOIC ACID
IUPAC Name: 2-(8-hydroxy-6-methoxy-1-oxoisochromen-3-yl)propanoic acid | CAS Registry Number: 181427-78-1
Synonyms: isocoumarin NM-3, NM 3 (isocoumarin), NM 3, NM-3, CID5493470, 2-(8-Hydroxy-6-methoxy-1-oxo-1H-isochromen-3-yl)propionic acid, 1H-2-Benzopyran-3-acetic acid, 8-hydroxy-6-methoxy-alpha-methyl-1-oxo-, 8-Hydroxy-6-methoxy-alpha-methyl-1-oxo-1H-2-benzopyran-3-acetic acid

Molecular Formula: C13H12O6Molecular Weight: 264.230780 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: BPZCXUROMKDLGX-UHFFFAOYSA-N

• 3-AZA-BICYCLO[3.1.0]HEXAN-6-YLMENTHOL
IUPAC Name: [(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]methanol | CAS Registry Number: 289037-48-5
Synonyms: 134575-13-6, (1R,5S,6R)-3-azabicyclo[3.1.0]hexan-6-ylmethanol, EXO-3-AZABICYCLO[3.1.0]HEXANE-6-METHANOL, cis-3-azabicyclo[3.1.0]hexan-6-ylmethanol, EN300-36123, (1R,5S)-3-azabicyclo[3.1.0]hex-6-ylmethanol, [(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol, (1R,5S,6R)-(3-Azabicyclo[3.1.0]hex-6-yl)methanol, ((1R,5S,6r)-3-azabicyclo[3.1.0]hexan-6-yl)methanol, [(1R,5S,6R)-3-azabicyclo[3.1.0]hexan-6-yl]methanol, endo-3-Azabicyclo[3.1.0]hexane-6-methanol, azabicyclohexanylmethanol, AC1Q77SA, SCHEMBL2281952, SCHEMBL2378612, SCHEMBL5325155, CTK8A2102, DTXSID30577255, MolPort-005-313-984, MolPort-016-582-185

Molecular Formula: C6H11NOMolecular Weight: 113.160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: YGYOQZPGFXHQMW-XEAPYIEGSA-N

• 2-PIPERIDINECARBOXYLIC ACID 2-METHYL-,(2S)-
IUPAC Name: (2S)-2-methylpiperidine-2-carboxylic acid | CAS Registry Number: 89115-95-7
Synonyms: 2-Piperidinecarboxylicacid, 2-methyl-, (2S)-, CTK3E6802, AKOS006350957, AG-H-60872, (S)-2-methylpiperidine-2-carboxylic acid, KB-63506, 2-Piperidinecarboxylicacid, 2-methyl-, (S)-; (S)-2-Pipecoline-2-carboxylic acid

Molecular Formula: C7H13NO2Molecular Weight: 143.183620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: GLNOAERYNWZGJY-ZETCQYMHSA-N

• 2-Dicyclohexylphosphino-2',6'-dimethoxybiphenyl
IUPAC Name: dicyclohexyl-[2-(2,6-dimethoxyphenyl)phenyl]phosphane | CAS Registry Number: 657408-07-6
Synonyms: SPhos, S-Phos, Dicyclohexyl(2',6'-dimethoxy-[1,1'-biphenyl]-2-yl)phosphine, dicyclohexyl[2-(2,6-dimethoxyphenyl)phenyl]phosphane, CHEMDOSE(TM), S-PHOS, 2-Dicyclohexylphosphino-2',6'-dimethoxy-1,1'-biphenyl, 2-Dicyclohexylphosphino-2,6-Dimethoxy-1,1-Biphenyl, AG-G-47504, 2-Dicyclohexylphosphino-2`,6`-dimethoxybiphenyl, 2-DICYCLOHEXYLPHOSPHINO-2,6-DIMETHOXYBIPHENYL, 2-DICYCLOHEXYLPHOSPHINO-2',6-DIMETHOXYBIPHENYL, [2-(2,6-DIMETHOXYPHENYL)PHENYL]DICYCLOHEXYLPHOSPHINE, DICYCLOHEXYL(2',6'-DIMETHOXYBIPHENYL-2-YL)PHOSPHINE, DICYCLOHEXYL-(2',6'-DIMETHOXY-BIPHENYL-2-YL)-PHOSPHANE, 2-Dicyclohexylphosphino-2 ,6 -dimethoxybiphenyl, PubChem23287, SureCN20304, AGN-PC-005OJQ, KSC623A5R, 638072_ALDRICH

Molecular Formula: C26H35O2PMolecular Weight: 410.528662 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: VNFWTIYUKDMAOP-UHFFFAOYSA-N

• 6-bromo-1-indanone
IUPAC Name: 6-bromo-2,3-dihydroinden-1-one | CAS Registry Number: 14548-39-1
Synonyms: 6-Bromo-1-indanone, 1-Indanone, 6-bromo-, 1-Indanone, 6-bromo-,, 597147_ALDRICH, TL8001006

Molecular Formula: C9H7BrOMolecular Weight: 211.055280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: SEQHEDQNODAFIU-UHFFFAOYSA-N

• 2-Bromo-5-fluoro-3-nitropyridine
IUPAC Name: 2-bromo-5-fluoro-3-nitropyridine | CAS Registry Number: 652160-72-0
Synonyms: 2-bromo-5-fluoro-3-nitropyridine, 2-Bromo-5-fluoro-2-nitropyrdine, AG-G-45385, PubChem14284, CTK5C2397, MolPort-002-041-396, 2-Bromo-5-fluoro-3-nitro-pyridine, 2-Bromo-5-fluoro-3-nitropyridine;, ANW-51808, SBB065642, ZINC02546085, Pyridine,2-bromo-5-fluoro-3-nitro-, AKOS005145688, LS20719, QC-3707, RP27284, 2-bromanyl-5-fluoranyl-3-nitro-pyridine, AK-35993, BR-35993, KB-21432

Molecular Formula: C5H2BrFN2O2Molecular Weight: 220.983983 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: XJFDIIHIXNIWQH-UHFFFAOYSA-N

• 1,3-Bis(2,4,6-Trimethylphenyl)-Imidazolidinium-Chloride
IUPAC Name: 1,3-bis(2,4,6-trimethylphenyl)imidazolidine;hydrochloride | CAS Registry Number: 173035-10-4
Synonyms: 1,3-DIMESITYLIMIDAZOLIDINE HYDROCHLORIDE, 1,3-DIMESITYLIMIDAZOLIDINE, CHLORIDE SALT, 1,3-BIS-(2,4,6-TRIMETHYL-PHENYL)-IMIDAZOLIDIN-1-IUM CHLORIDE, 1,3-BIS(2,4,6-TRIMETHYLPHENYL)-IMIDAZOLIDINIUM-CHLORIDE, MB03408, SC11711

Molecular Formula: C21H29ClN2Molecular Weight: 344.921360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: HOOKQVAAJVEFHV-UHFFFAOYSA-N

• 1,3-Bis(2,6-Diisopropylphenyl)imidazolinium Chloride,
IUPAC Name: 1,3-bis[2,6-di(propan-2-yl)phenyl]-4,5-dihydroimidazol-1-ium | CAS Registry Number: 258278-25-0
Synonyms: ZINC02529855, CID2734919

Molecular Formula: C27H39N2+Molecular Weight: 391.611960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: SCEZRJLZOZKPBC-UHFFFAOYSA-N

• 2-Methyloctahydro-1h-Pyrrolo[3,4-C]pyridine
IUPAC Name: 2-methyl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine | CAS Registry Number: 885959-24-0
Synonyms: 2-Methyl-octahydro-pyrrolo[3,4-c]pyridine, 2-Methyloctahydropyrrolo[3,4-c]pyridine, 2-Methyl-octahydro-pyrrolo3,4-cpyridine, 2-METHYL-OCTAHYDRO-PYRROLO(3,4-C)PYRIDINE, SureCN1991711, AGN-PC-0207AJ, CTK5G0855, MolPort-000-004-658, ANW-69234, AKOS006284552, AG-H-57918, PB20995, 2-methyl-octahydropyrrolo[3,4-c]pyridine, AK-36732, KB-25543, KB-231728, A11768, M40009, 2-METHYLOCTAHYDRO-1H-PYRROLO[3,4-C]PYRIDINE, I14-15035

Molecular Formula: C8H16N2Molecular Weight: 140.226040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: BKVNPJOJIGXEPB-UHFFFAOYSA-N

• 2-Benzyl-Cotahydro-Pyrrolo[3,4-C]pridine
IUPAC Name: 2-benzyl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine | CAS Registry Number: 351370-98-4
Synonyms: AmbTiB64521, 2-Benzyl-octahydro-pyrrolo[3,4-c]pyridine, B64521

Molecular Formula: C14H20N2Molecular Weight: 216.322000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VZMAYQMDXZLZFZ-UHFFFAOYSA-N

• 6-Oxabicyclo[3.1.0]hexane, 3-(phenylmethoxy)-2-[(phenylmethoxy)methyl]-, (1S,2R,3S,5R)-
IUPAC Name: (1S,2R,3S,5R)-3-phenylmethoxy-2-(phenylmethoxymethyl)-6-oxabicyclo[3.1.0]hexane | CAS Registry Number: 110567-22-1
Synonyms: (1S,2R,3S,5R)-3-(Benzyloxy)-2-((benzyloxy)methyl)-6-oxabicyclo[3.1.0]hexane, (1S,2R,3S,5R)-3-(Phenylmethoxy)-2-[(phenylmethoxy)methyl]-6-oxabicyclo[3.1.0]hexane, CTK8B4864, ANW-46553, RW2434, SBB068701, ZINC22065835, AKOS015918406, AC-5918, AK-29771, KB-00798, FT-0649366, R3-03, X8951, I14-8284, 6-Oxabicyclo[3,1,0]hexane-3-(phenylmetyoxy)-2-[(phenylmethoxy)methyl]-(1S,2R,3S,5R), [1S-(1|A,2|A,3|A,5|A)]-3-(Phenylmethoxy)-2-[(phenylmethoxy)methyl]-6-oxabicyclo[3.1.0]hexane

Molecular Formula: C20H22O3Molecular Weight: 310.386880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: YPDRJNPIGFCETD-WCIQWLHISA-N


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