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Wuhan TCASChem Tech Co., Ltd.

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Address: 1019 Xiongchu Avenue, Hongshan District, Wuhan, Hubei 430074, China
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Profile: Wuhan TCASChem Tech Co., Ltd. is a supplier of pharmaceuticals, pesticides, high-end intermediates, and chemical reagents. Our products include 5-bromo-2-nitrobenzaldehyde, lithium phenylacetylide, pengitoxin, vinyl fluoride, 3,5-dimethyl nitrobenzene, difluoromethane, tungstosilicic acid, diethylene glycol, and 6-methyl isoquinoline.

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• Methyl-4-Iodo-3-Hydroxy Benzoate
IUPAC Name: methyl 3-hydroxy-4-iodobenzoate | CAS Registry Number: 157942-12-6
Synonyms: methyl 3-hydroxy-4-iodobenzoate, 3-Hydroxy-4-iodobenzoic acid methyl ester, Methyl-4-iodo-3-hydroxy benzoate, SBB068814, 3-hydroxy-4-iodo-benzoic acid methyl ester, SureCN976862, CTK6I9775, ANW-47515, ZINC08700304, methyl 4-iodanyl-3-oxidanyl-benzoate, AKOS005073538, AG-C-12642, MCULE-7863784257, QC-1581, RP15376, AK-31800, BR-31800, Methyl 3-hydroxy-4-iodobenzenecarboxylate, TL80090660, W3431

Molecular Formula: C8H7IO3Molecular Weight: 278.043850 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LXCQVWRESZDFGW-UHFFFAOYSA-N

• Methyl2-methoxy-4-methylbenzoate
IUPAC Name: methyl 2-methoxy-4-methylbenzoate | CAS Registry Number: 81245-24-1
Synonyms: methyl 2-methoxy-4-methylbenzoate, ZINC04290724, ACMC-209vzr, AC1OGP9C, SureCN136101, CTK3E4653, MolPort-000-160-274, ANW-45733, CL9025, RW4102, AKOS000297423, AM83135, AS04422, RP24159, AK-38348, KB-53937, 2-Methoxy-4-methylbenzoic acid methyl ester, BB 0244694, FT-0650570, W8578

Molecular Formula: C10H12O3Molecular Weight: 180.200480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: LHNVKRSDQCCHEK-UHFFFAOYSA-N

• Methyl4,6-dichloropyridazine-3-carboxylate
IUPAC Name: methyl 4,6-dichloropyridazine-3-carboxylate | CAS Registry Number: 372118-01-9
Synonyms: Methyl 4,6-dichloropyridazine-3-carboxylate, 4,6-Dichloro-4-(methoxycarbonyl)pyridazine, 3-PYRIDAZINECARBOXYLIC ACID, 4,6-DICHLORO-, METHYL ESTER, AGN-PC-01MIMI, CTK8C5271, MolPort-009-199-177, ANW-74999, AKOS015919938, AB55529, OR20002, QC-1126, RP26279, AK-34901, BR-34901, KB-256865, W5824, 4,6-DICHLORO-3-PYRIDAZINECARBOXYLIC ACID METHYL ESTER, 4,6-DICHLORO-PYRIDAZINE-3-CARBOXYLIC ACID METHYL ESTER

Molecular Formula: C6H4Cl2N2O2Molecular Weight: 207.014160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: MZEVRGMQXLNKEZ-UHFFFAOYSA-N

• METHYLTRIBUTYLPHOSPHONIUM IODIDE
IUPAC Name: tributyl(methyl)phosphanium iodide | CAS Registry Number: 1702-42-7
Synonyms: Methyltributylphosphonium Iodide, Tributylmethylphosphonium Iodide, MolPort-000-157-598, MolPort-001-797-426, Tributyl-methyl-phosphanium Iodide, NSC41941, CID2760114, M1455

Molecular Formula: C13H30IPMolecular Weight: 344.255531 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RLZMYANQLOCZOB-UHFFFAOYSA-M

• Morpholine-3,4-dicarboxylic acid 4-tert-butyl ester
IUPAC Name: (3S)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-3-carboxylate | CAS Registry Number: 212650-43-6
Synonyms: ZINC01433128, CID6987997

Molecular Formula: C10H16NO5-Molecular Weight: 230.237740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: KVXXEKIGMOEPSA-ZETCQYMHSA-M

• N,N'-DIPYRIDIN-3-YLUREA
IUPAC Name: 1,3-dipyridin-3-ylurea | CAS Registry Number: 39642-60-9
Synonyms: 1,3-Di(pyridin-3-yl)urea, 1,3-dipyridin-3-ylurea, N,N'-BIS(3-PYRIDYL)UREA, AJ-333/25006232, ZINC00334974, AC1LGDA1, AC1Q5NRG, N,N'-dipyridin-3-ylurea, 1,3-Bis(3-pyridyl)urea, SureCN9637653, CTK4I1673, MolPort-003-802-507, KST-1B3954, ANW-44510, AR-1B7194, SBB094957, AKOS015999494, AG-C-13520, AG-F-40104, AK-93432

Molecular Formula: C11H10N4OMolecular Weight: 214.223300 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: CJYIFBGXLCPMDQ-UHFFFAOYSA-N

• N,N-Bis(2-Chloroethyl)Benzenemethanamine
IUPAC Name: N-benzyl-2-chloro-N-(2-chloroethyl)ethanamine | CAS Registry Number: 55-51-6
Synonyms: N-Benzylnormechlorethamine, Benzyl nor-mechlorethamine, Bis(2-chloroethyl)benzylamine, Benzylbis(beta-chloroethyl)amine, Di-(2-chloroethyl)-benzylamine, TL 695, N,N-Bis(2-chloroethyl)benzylamine, CID5928, N-Benzyl-N,N-bis(2-chloroethyl)amine, BRN 2099546, N,N-Bis(2-chloroethyl)benzenemethanamine, Benzenemethanamine, N,N-bis(2-chloroethyl)-, BENZYLAMINE, N,N-BIS(2-CHLOROETHYL)-, LS-43174, STT-00261049, 4-12-00-02164 (Beilstein Handbook Reference)

Molecular Formula: C11H15Cl2NMolecular Weight: 232.149500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: VLWJKVNMRMHPCC-UHFFFAOYSA-N

• N,N-DIMETHYL 4-CHLOROBENZAMIDE
IUPAC Name: 4-chloro-N,N-dimethylbenzamide | CAS Registry Number: 14062-80-7
Synonyms: 4-Chloro-N,N-dimethylbenzamide, ARONIS24019, Benzamide, 4-chloro-N,N-dimethyl-, N,N-Dimethyl p-chlorobenzamide, p-Chloro-N,N-dimethylbenzamide, ARONIS023855, NSC38420, STOCK1S-54641, MolPort-002-319-260, Benzamide, p-chloro-N,N-dimethyl-, CID84180, EINECS 237-909-9, STK395611, ZINC00500219, AI3-30807

Molecular Formula: C9H10ClNOMolecular Weight: 183.634800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: FARSXMMESQDZMY-UHFFFAOYSA-N

• N-(2,4-Dimethoxybenzyl)-N-Methylamine
IUPAC Name: (2,4-dimethoxyphenyl)methyl-methylazanium | CAS Registry Number: 102503-23-1
Synonyms: ZINC03300891, CID2416535

Molecular Formula: C10H16NO2+Molecular Weight: 182.239540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ULVUWTHGZHDWMW-UHFFFAOYSA-O

• N-(2-Aminoethyl)-N-methyl carbamic acid tert-butyl ester
IUPAC Name: tert-butyl N-(2-aminoethyl)-N-methylcarbamate | CAS Registry Number: 121492-06-6
Synonyms: N-Boc-N-methylethylenediamine, n-boc-n-methyl-ethylenediamine, N-Boc-(2-Aminoethyl)-N-methylamine, tert-Butyl N-(2-aminoethyl)-N-methylcarbamate, SBB070199, AG-D-46613, tert-butyl 2-aminoethyl(methyl)carbamate, tert-Butyl N-methyl-N-(2-aminoethyl)carbamate, N-(2-Aminoethyl)-N-methylcarbamicacidtert-butylester, AC1MBTJH, AC1Q3XHB, ACMC-1C5QR, boc-n-methylethylenediamine, KSC495C7R, 15567_ALDRICH, (n-boc-n-methyl)ethylenediamine, N-boc-N-methyl ethyl enediamine, 15567_FLUKA, CTK3J5178, MolPort-000-151-049

Molecular Formula: C8H18N2O2Molecular Weight: 174.240720 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: QYJVBVKFXDHFPQ-UHFFFAOYSA-N

• N-(2-methoxyphenyl)nicotinamide
IUPAC Name: N-(2-methoxyphenyl)pyridine-3-carboxamide | CAS Registry Number: 70301-27-8
Synonyms: N-(2-Methoxy-phenyl)-nicotinamide, N-(2-methoxyphenyl)pyridine-3-carboxamide, AE-848/32590004, ZINC00284969, CBMicro_049002, AC1LG10F, SureCN4651272, Oprea1_848062, MLS000528940, CTK2G3047, MolPort-001-992-897, HMS2342D13, ANW-53043, STK043098, AKOS000673493, MCULE-1398244217, AK-86532, BAS 03585824, N-(2-methoxyphenyl)-3-pyridylcarboxamide, SMR000121415

Molecular Formula: C13H12N2O2Molecular Weight: 228.246580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: JTYKITZXNYVOSY-UHFFFAOYSA-N

• N-(3,4-DIMETHYLPHENYL)-3-OXO-BUTANAMIDE
IUPAC Name: N-(3,4-dimethylphenyl)-3-oxobutanamide | CAS Registry Number: 50334-96-8
Synonyms: Ambcb5200315, MolPort-000-893-941, NSC165876, CID296087, STK350648, ZINC03885185, N-(3,4-dimethylphenyl)-3-oxobutanamide

Molecular Formula: C12H15NO2Molecular Weight: 205.253000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: KKSJXJUYTRVZNM-UHFFFAOYSA-N

• N-(3-Aminopropyl)methacrylamide Hydrochloride
IUPAC Name: N-(3-aminopropyl)-2-methylprop-2-enamide hydrochloride | CAS Registry Number: 72607-53-5
Synonyms: CID10375005, N-(3-aminopropyl)-2-methyl-prop-2-enamide Hydrochloride, 2-Propenamide, N-(3-aminopropyl)-2-methyl-, monohydrochloride, 2-Propenamide, N-(3-aminopropyl)-2-methyl-, hydrochloride (1:1)

Molecular Formula: C7H15ClN2OMolecular Weight: 178.659800 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: XHIRWEVPYCTARV-UHFFFAOYSA-N

• N-(4-BROMOPHENYL)GUANIDINE
IUPAC Name: 2-(4-bromophenyl)guanidine | CAS Registry Number: 67453-81-0
Synonyms: F2158-0682, N-(4-bromophenyl)guanidine, 1-(4-bromophenyl)guanidine, SureCN1676492, SureCN2447318, Guanidine, (4-bromophenyl)-, (4-BROMOPHENYL)GUANIDINE, CHEMBL1160763, CTK1H7787, AKOS011667950, AG-G-55028

Molecular Formula: C7H8BrN3Molecular Weight: 214.062520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: RNEXKKNNOIRYGI-UHFFFAOYSA-N

• N-(4-bromophenyl)picolinamide
IUPAC Name: N-(4-bromophenyl)pyridine-2-carboxamide | CAS Registry Number: 14547-73-0
Synonyms: N-(4-Bromophenyl)picolinamide, ZINC00362831, AC1LHD3C, CTK8B6235, MolPort-002-826-456, ANW-53044, AKOS000185262, MCULE-8033449164, N-(4-bromophenyl)pyridine-2-carboxamide, AK-86518, KB-258201, T5451129

Molecular Formula: C12H9BrN2OMolecular Weight: 277.116660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RAJKUZRIZUSGKU-UHFFFAOYSA-N

• N-(pyridin-2-yl)benzo[d]oxazol-2-amine
IUPAC Name: N-pyridin-2-yl-1,3-benzoxazol-2-amine | CAS Registry Number: 6458-60-2
Synonyms: N-(Pyridin-2-yl)benzo[d]oxazol-2-amine, AC1M4DUP, Oprea1_420092, CTK8C1552, MolPort-004-024-938, ANW-66879, AKOS003614916, N-pyridin-2-yl-1,3-benzoxazol-2-amine, AK-95309, KB-258306

Molecular Formula: C12H9N3OMolecular Weight: 211.219360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: YMRWEBLZMFGRTH-UHFFFAOYSA-N

• N-[4-(Dimethylamino)phenyl]guanidine
IUPAC Name: 2-[4-(dimethylamino)phenyl]guanidine | CAS Registry Number: 67453-82-1
Synonyms: N-[4-(dimethylamino)phenyl]guanidine, F2158-0400, AC1MHLT4, SureCN4154606, CHEMBL231585, p-(Dimethylamino)phenylguanidine, NIOSH/MF0650000, CHEBI:488729, MolPort-007-994-882, 2-(4-dimethylaminophenyl)guanidine, ZINC26423543, 1-[4-(dimethylamino)phenyl]guanidine, AKOS005208322, MCULE-6961278653, Guanidine, N-(p-(dimethylamino)phenyl)-, LS-73581, MF06500000

Molecular Formula: C9H14N4Molecular Weight: 178.234260 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: NAAHSJLHESEXLU-UHFFFAOYSA-N

• N-benzyl glycine hydrochloride
IUPAC Name: 2-(benzylamino)acetic acid chloride | CAS Registry Number: 7689-50-1
Synonyms: NSC25487

Molecular Formula: C9H11ClNO2-Molecular Weight: 200.642140 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: BUZJPENZWLUHJD-UHFFFAOYSA-M

• N-Benzyl-bis(2-chloroethyl)amine hydrochloride
IUPAC Name: bis(2-chloroethyl)-(phenylmethyl)azanium chloride | CAS Registry Number: 10429-82-0
Synonyms: Embitol, Benzyl-bis(2-chloroethyl)amine hydrochloride, LS-43195, N,N-Bis(2-chloroethyl)benzylamine hydrochloride, N,N-Bis(2-chloroethyl)benzenemethanamine hydrochloride, 6X-0950, BENZYLAMINE, N,N-BIS(2-CHLOROETHYL)-, HYDROCHLORIDE

Molecular Formula: C11H16Cl3NMolecular Weight: 268.610440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: AZRWNJFEUSHORT-UHFFFAOYSA-N

• N-BENZYL-N-METHYL-1,2-DIAMINOETHANE
IUPAC Name: N'-(cyclohexylmethyl)-N'-methylethane-1,2-diamine | CAS Registry Number: 61694-86-8
Synonyms: 1,2-Ethanediamine, N-(cyclohexylmethyl)-N-methyl-, AGN-PC-00JTS9, SureCN11666812, CTK2D4474, AKOS009464682

Molecular Formula: C10H22N2Molecular Weight: 170.295080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QGFPUCMVOVIMBK-UHFFFAOYSA-N

• N-Boc-1,2,3,6-Tetrahydropyridine
IUPAC Name: tert-butyl 3,6-dihydro-2H-pyridine-1-carboxylate | CAS Registry Number: 85838-94-4
Synonyms: ZINC15022029, 1-Boc-1,2,3,6-tetrahydro-pyridine, OR15688, FS011274

Molecular Formula: C10H17NO2Molecular Weight: 183.247480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SHHHRQFHCPINIB-UHFFFAOYSA-N

• N-Boc-2-amino-5-bromothiazole
IUPAC Name: tert-butyl N-(5-bromo-1,3-thiazol-2-yl)carbamate | CAS Registry Number: 405939-39-1
Synonyms: N-Boc-2-Amino-5-bromothiazole, tert-butyl 5-bromothiazol-2-ylcarbamate, tert-butyl N-(5-bromo-1,3-thiazol-2-yl)carbamate, PubChem8907, MolPort-003-823-882, ZINC08698450, AKOS000282826, AB32049, ACN-000935, QC-6371, RP29805, AK-21805, BR-21805, EN000351, tert-Butyl (5-bromothiazol-2-yl)carbamate, FT-0646197, ST51053581, W6110, tert-butyl 5-bromo-1,3-thiazol-2-ylcarbamate, I09-0941

Molecular Formula: C8H11BrN2O2SMolecular Weight: 279.154140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: OIBKBVFFZYCBAQ-UHFFFAOYSA-N

• N-Boc-3-hydroxyazetidine
IUPAC Name: tert-butyl 3-hydroxyazetidine-1-carboxylate | CAS Registry Number: 141699-55-0
Synonyms: ZINC02527471, ALBB-009728, 1-BOC-3-(HYDROXY)AZETIDINE, CID2756801, FS011275, tert-butyl 3-hydroxyazetidine-1-carboxylate, TL8000922

Molecular Formula: C8H15NO3Molecular Weight: 173.209600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XRRXRQJQQKMFBC-UHFFFAOYSA-N

• N-Boc-4-piperidineethanol
IUPAC Name: tert-butyl 4-(2-hydroxyethyl)piperidine-1-carboxylate | CAS Registry Number: 89151-44-0
Synonyms: 1-Boc-4-(2-hydroxyethyl)piperidine, Tert-butyl 4-(2-hydroxyethyl)piperidine-1-carboxylate, N-(tert-Butoxycarbonyl)-4-piperidineethanol, 1-(tert-Butoxycarbonyl)-4-(2-hydroxyethyl)piperidine, 4-(2-HYDROXYETHYL)PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER, PubChem16333, ACMC-209qyt, SureCN310405, AC1LGZ19, KSC903S0R, 547247_ALDRICH, CTK8A3908, MolPort-000-001-570, ACT10942, BOC-2-(4-PIPERIDYL)ETHANOL, ANW-39219, FC0432, SBB097482, WT1243, ZINC00404091

Molecular Formula: C12H23NO3Molecular Weight: 229.315920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: YBNJZIDYXCGAPX-UHFFFAOYSA-N

• N-BOC-M-PHENYLENEDIAMINE
IUPAC Name: tert-butyl N-(3-aminophenyl)carbamate | CAS Registry Number: 68621-88-5
Synonyms: N-Boc-m-phenylenediamine, T-butyl-3-aminophenylcarbamate, (3-Aminophenyl)carbamic acid tert-butyl ester, (3-aminophenyl)carbamic acid, 1,1-dimethylethyl ester, tert-butyl N-(3-aminophenyl)carbamate, tert-Butyl-3-aminophenylcarbamate, 3-(tert-Butoxycarbonylamino)aniline, zlchem 762, ACMC-1B3NR, AGN-PC-00JWAE, SureCN656043, 53175_ALDRICH, 53175_FLUKA, CTK8B5564, tert-butyl 3-aminophenylcarbamate, ZLD0220, MolPort-003-984-981, ACT06063, tert-Butyl (3-aminophenyl)carbamate, ANW-49150

Molecular Formula: C11H16N2O2Molecular Weight: 208.256940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IEUIEMIRUXSXCL-UHFFFAOYSA-N

• N-Boc-N-Methoxy-3-Aminopropionic Acid
IUPAC Name: 3-[methoxy-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid | CAS Registry Number: 172299-81-9
Synonyms: 3-((tert-Butoxycarbonyl)(methoxy)amino)propanoic acid, N-Boc-N-methoxy-3-aminopropionicacid, N-Boc-N-methoxy-3-aminopropionic acid, PubChem11750, CTK4D4189, MolPort-020-233-890, ANW-48578, RW3232, AKOS015909961, AG-E-21584, RP27188, AK-61197, BR-61197, KB-232350, FT-0604035, W3755, N-BOC-N-METHOXY-3-AMINOPROPANOIC ACID, 3-(tert-butoxycarbonyl(methoxy)amino)propanoic acid, I14-31805

Molecular Formula: C9H17NO5Molecular Weight: 219.234980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: UIRKPSPBQPPPFX-UHFFFAOYSA-N

• N-Chloro-p-benzoquinoneimine
IUPAC Name: 4-chloroiminocyclohexa-2,5-dien-1-one | CAS Registry Number: 637-61-6
Synonyms: Quinone chlorimide, Benzoquinone chlorimine, N-Chloro-p-quinone imine, p-Benzoquinone-N-chloroimide, p-Benzoquinone-N-chloroimine, p-Quinone-4-chloroimide, p-Benzoquinone imine, N-chloro-, Benzoquinone imine, N-chloro-, WLN: L6V DYJ DUNG, N-Chloro-p-quinone Monoimine, NSC 448, NSC448, 4-Chloroimino-2,5-cyclohexadiene-1-one, MolPort-003-987-077, N-Chloro-p-benzoquinone Monoimine, CID12505, BRN 2612525, ZINC01555531, 2,5-Cyclohexadien-1-one, 4-(chloroimino)-, LS-56309

Molecular Formula: C6H4ClNOMolecular Weight: 141.555060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ITUYMTWJWYTELW-UHFFFAOYSA-N

• N-Ethyl-N-methyl-2-(3-piperidinyloxy)acetamide
IUPAC Name: N-ethyl-N-methyl-2-piperidin-3-yloxyacetamide

Molecular Formula: C10H20N2O2Molecular Weight: 200.278000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: RGAXXCQGYNHPFO-UHFFFAOYSA-N

• N-isopropyl-4-phenylthiazol-2-amine
IUPAC Name: 4-phenyl-N-propan-2-yl-1,3-thiazol-2-amine | CAS Registry Number: 691905-18-7
Synonyms: N-Isopropyl-4-phenylthiazol-2-amine, T5853179, ZINC07763122, AC1PFA2A, Oprea1_417942, CTK8C1551, MolPort-005-591-987, ANW-66876, AKOS006037740, MCULE-9396434274, AK-95312, KB-258806, 4-phenyl-N-propan-2-yl-1,3-thiazol-2-amine

Molecular Formula: C12H14N2SMolecular Weight: 218.317960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FMWHLMNDIGKCEH-UHFFFAOYSA-N

• N-ME-AIB-OH HCL
IUPAC Name: 2-methyl-2-(methylamino)propanoic acid | CAS Registry Number: 2566-34-9
Synonyms: N,2-dimethylalanine, 2,N-Dimethylalanine, 2-(Methylamino)isobutyric acid, M2383_SIGMA, alpha-(Methylamino)isobutyric acid, MolPort-003-925-307, alpha-(Methylamino)-isobutyric acid, CID75725, EINECS 219-898-2, 2-(Methylamino)-2-methylpropionic acid, M1388

Molecular Formula: C5H11NO2Molecular Weight: 117.146340 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: DLAMVQGYEVKIRE-UHFFFAOYSA-N

• N-METHYL 3-AMINOBENZENESULFONAMIDE
IUPAC Name: 3-amino-N-methylbenzenesulfonamide | CAS Registry Number: 459434-40-3
Synonyms: Ambnee5988570, MolPort-002-461-764, ZINC04352779, CID7204890

Molecular Formula: C7H10N2O2SMolecular Weight: 186.231500 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: SFCWILLFDXUKRB-UHFFFAOYSA-N

• N-METHYL-1-(1-METHYLPIPERIDIN-2-YL)METHANAMINE
IUPAC Name: N-methyl-1-(1-methylpiperidin-2-yl)methanamine | CAS Registry Number: 184637-50-1
Synonyms: Ambnee4100052, MolPort-001-794-876, ALBB-009287, STK505806, CID10240913, N-methyl-1-(1-methylpiperidin-2-yl)methanamine, N-methyl(1-methyl-2-piperidinyl)methanamine, EC-000.1303, N-methyl-1-(1-methyl-2-piperidyl)methanamine

Molecular Formula: C8H18N2Molecular Weight: 142.241920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: WXCNRPZWUCFNHZ-UHFFFAOYSA-N

• N-METHYL-4-(METHYLTHIO)BENZAMIDE
IUPAC Name: N-methyl-4-methylsulfanylbenzamide | CAS Registry Number: 53551-23-8
Synonyms: N-methyl-4-methylsulfanyl-benzamide, AC1NCVXC, SureCN9102885, AC1Q40L4, CTK8C1555, MolPort-001-845-841, N-methyl-4-methylsulfanylbenzamide, ANW-66884, N-methyl-4-(methylsulfanyl)benzamide, AKOS008955174, MCULE-6157710609, AK-95304, KB-258999

Molecular Formula: C9H11NOSMolecular Weight: 181.254740 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UTWKXHLTRDUFAC-UHFFFAOYSA-N

• N-Methyl-N-[4-(trifluoromethyl)benzyl]amine
IUPAC Name: N-methyl-1-[4-(trifluoromethyl)phenyl]methanamine | CAS Registry Number: 90390-11-7
Synonyms: Benzylamine der, AIDS107206, AIDS-107206, 90389-03-0 (HYDROCHLORIDE), MO 00896, Benzenemethanamine, N-methyl-4-(trifluoromethyl)-

Molecular Formula: C9H10F3NMolecular Weight: 189.177610 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: YMSMEZAYZIYFGA-UHFFFAOYSA-N

• N-METHYL-VAL-OBZL.TOSOH
IUPAC Name: 2-[benzyl(methyl)amino]-3-methylbutanoic acid | CAS Registry Number: 42492-62-6
Synonyms: N-Benzylvaline, NSC86090, MolPort-003-766-071, CID257694, Butanoic acid, 3-methyl-2-(benzylmethylamino)-

Molecular Formula: C13H19NO2Molecular Weight: 221.295460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BLRQXMHAGNJVHO-UHFFFAOYSA-N

• N-OCTYL PHENYL ETHER
IUPAC Name: octoxybenzene | CAS Registry Number: 1818-07-1
Synonyms: Octyl phenyl ether, n-Octyloxybenzene, Ether, octyl phenyl, Benzene, (octyloxy)-, n-Octyl Phenyl Ether, CID74558, O0224

Molecular Formula: C14H22OMolecular Weight: 206.323880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ZPIRTVJRHUMMOI-UHFFFAOYSA-N

• N-phenyl-4-methoxybenzylamine
IUPAC Name: N-[(4-methoxyphenyl)methyl]aniline | CAS Registry Number: 3526-43-0
Synonyms: N-Phenyl-4-methoxybenzylamine, N-(4-Methoxybenzyl)aniline, (4-Methoxy-benzyl)-phenyl-amine, N-[(4-methoxyphenyl)methyl]aniline, AC1L8UMA, AC1Q4CRA, 5427-61-2, SureCN2306553, Oprea1_211513, Oprea1_874991, N-(4-methoxybenzyl)benzenamine, CHEMBL258517, STOCK6S-65149, MolPort-001-828-586, 4-Methoxy-N-phenylbenzenemethanamine, [(4-methoxyphenyl)methyl]phenylamine, ANW-44314, CL8688, FC1179, STK730498

Molecular Formula: C14H15NOMolecular Weight: 213.275000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: WRDZMZGYHVUYRU-UHFFFAOYSA-N

• N1-Benzyl-N1-Methylethane-1,2-Diamine
IUPAC Name: N-benzyl-N-methylethane-1,2-diamine | CAS Registry Number: 14165-18-5
Synonyms: ChemDiv2_003237, N-Benzyl-N-methyl-1,2-diaminoethane, CID3014812, N-Methyl-N-(phenylmethyl)-1,2-ethanediamine, 1,2-Ethanediamine, N-methyl-N-(phenylmethyl)-

Molecular Formula: C10H16N2Molecular Weight: 164.247440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LIUGRXFEJOSPIA-UHFFFAOYSA-N

• N1-cyclohexyl-N1-methyl-1,2-Ethanediamine
IUPAC Name: N'-cyclohexyl-N'-methylethane-1,2-diamine | CAS Registry Number: 14256-69-0
Synonyms: N-(2-aminoethyl)-N-methylcyclohexanamine, 245487-33-6, (2-aminoethyl)cyclohexylmethylamine, N-cyclohexyl-N-methylethane-1,2-diamine, AC1OFY8J, SureCN3186493, CTK4C3186, MolPort-002-678-891, BB_SC-8645, ALBB-005367, ANW-48605, BBL011822, RW3198, RW3234, SBB017937, STK500901, AKOS000150946, AG-L-60386, MCULE-4887946177, QC-2281

Molecular Formula: C9H20N2Molecular Weight: 156.268500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FNZNHTIBNDAHFH-UHFFFAOYSA-N

• Naphthylene-2-Acetylene
IUPAC Name: 2-ethynylnaphthalene | CAS Registry Number: 2949-26-0
Synonyms: 2-Ethynylnaphthalene, Naphthalene, 2-ethynyl-, CCRIS 4255, CID115017, InChI=1/C12H8/c1-2-10-7-8-11-5-3-4-6-12(11)9-10/h1,3-9

Molecular Formula: C12H8Molecular Weight: 152.191920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: IZXPFTLEVNQLGD-UHFFFAOYSA-N

• NH2-PEG3
IUPAC Name: 2-[2-(2-aminoethoxy)ethoxy]ethanol | CAS Registry Number: 6338-55-2
Synonyms: NSC40760, CID95875, Ethanol, 2-(2-(2-aminoethoxy)ethoxy)-

Molecular Formula: C6H15NO3Molecular Weight: 149.188200 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: ASDQMECUMYIVBG-UHFFFAOYSA-N

• NICOTINOYLACETONE
IUPAC Name: 1-pyridin-3-ylbutane-1,3-dione | CAS Registry Number: 3594-37-4
Synonyms: Nicotinoylacetone, 1,3-Butanedione, 1-(3-pyridyl)-, MolPort-001-790-260, NSC174282, 1-(3-Pyridyl)-1,3-butanedione, 1,3-Butanedione, 1-(3-pyridinyl)-, CID300160

Molecular Formula: C9H9NO2Molecular Weight: 163.173260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: OVPXWZQQDUKDFN-UHFFFAOYSA-N

• O-Dibromobenzene
IUPAC Name: 1,2-dibromobenzene | CAS Registry Number: 583-53-9
Synonyms: o-Dibromobenzene, Benzene, o-dibromo-, Benzene, 1,2-dibromo-, 1,2-DIBROMOBENZENE, Benzene, dibromo-, DIBROMOBENZENE, ortho-Dibromobenzene, BENZENE,1,2-DIBROMO, D39002_ALDRICH, Benzene, o-dibromo- (8CI), 33971_FLUKA, CHEBI:37152, EINECS 209-507-3, EINECS 247-544-7, NSC 60643, UN2711, CID11414, NSC60643, AI3-10009, LS-29658

Molecular Formula: C6H4Br2Molecular Weight: 235.903960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: WQONPSCCEXUXTQ-UHFFFAOYSA-N

• O-Iodobenzoyl Chloride
IUPAC Name: 2-iodobenzoyl chloride | CAS Registry Number: 609-67-6
Synonyms: 2-Iodobenzoyl chloride, o-Iodobenzoyl chloride, Benzoyl chloride, 2-iodo-, 252115_ALDRICH, 57745_FLUKA, CID69112, EINECS 210-196-1, ZINC01845984, InChI=1/C7H4ClIO/c8-7(10)5-3-1-2-4-6(5)9/h1-4

Molecular Formula: C7H4ClIOMolecular Weight: 266.463530 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: MVIVDSWUOGNODP-UHFFFAOYSA-N

• Oltipraz
IUPAC Name: 4-methyl-5-pyrazin-2-yldithiole-3-thione | CAS Registry Number: 64224-21-1
Synonyms: Oltiprazum, Oltipraz [INN], 4-methyl-PDT, Oltiprazum [INN-Latin], CCRIS 4048, UNII-6N510JUL1Y, C8H6N2S3, EINECS 264-736-6, CHEBI:400769, NSC347901, AIDS042741, HMS2090F09, RP 35972, NSC 347901, AIDS-042741, CID47318, BRN 0978110, RP-35,972, LS-7628, 4-Methyl-5-pyrazinyl-3H-1,2-dithiole-3-thione

Molecular Formula: C8H6N2S3Molecular Weight: 226.341640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: CKNAQFVBEHDJQV-UHFFFAOYSA-N

• Oxetan-3-ol
IUPAC Name: oxetan-3-ol | CAS Registry Number: 7748-36-9
Synonyms: 3-HYDROXYOXETANE, 3-OXETANOL, 1,3-Epoxy-2-propanol, PubChem17367, AC1Q7AQW, SureCN38019, JSPY-st000223, KSC380K3T, 1,3-EPOXYPROPAN-2-OL, CTK2I0539, 7748-36-9 oxetan-3-ol, BH264, HT164, ACN-S003412, ACT03007, ANW-51414, FC0231, WTI-11884, ZINC33359293, AKOS005146130

Molecular Formula: C3H6O2Molecular Weight: 74.078540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QMLWSAXEQSBAAQ-UHFFFAOYSA-N

• Oxindole
IUPAC Name: 1,3-dihydroindol-2-one | CAS Registry Number: 59-48-3
Synonyms: 2-Indolinone, Indolin-2-one, Oxindol, 2-Oxindole, 2-Oxoindoline, 1,3-Dihydroindol-2-one, Indol-2(3H)-one, indolin-2(1H)-one, 1,3-Dihydro-2H-indol-2-one, O9808_ALDRICH, 2H-Indol-2-one, 1,3-dihydro-, 57260_FLUKA, CHEBI:31697, CPD-6361, NSC274863, SBB004215, ZINC00058282, TL806283, C12312, AH-034/32845032

Molecular Formula: C8H7NOMolecular Weight: 133.147280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: JYGFTBXVXVMTGB-UHFFFAOYSA-N

• P-NITROSOTOLUENE
IUPAC Name: 1-methyl-4-nitrosobenzene | CAS Registry Number: 623-11-0
Synonyms: p-Nitrosotoluene, 4-Nitrosotoluene, p-Methylnitrosobenzene, 4-Methylnitrosobenzene, 1-Methyl-4-nitrosobenzene, TOLUENE, p-NITROSO-, Benzene, 1-methyl-4-nitroso-, EINECS 210-771-7, CID12166, BRN 1854613, LS-154080, 4-05-00-00845 (Beilstein Handbook Reference), InChI=1/C7H7NO/c1-6-2-4-7(8-9)5-3-6/h2-5H,1H

Molecular Formula: C7H7NOMolecular Weight: 121.136580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NYJYFSGMYHSTNZ-UHFFFAOYSA-N

• P-Xylenolphthalein
IUPAC Name: 3,3-bis(4-hydroxy-2,5-dimethylphenyl)-2-benzofuran-1-one | CAS Registry Number: 50984-88-8
Synonyms: p-Xylenolphthalein, 95620_FLUKA, EINECS 256-893-4, CID628858, 3,3-Bis(4-hydroxy-2,5-xylyl)phthalide, 2',5',2'',5''-Tetramethylphenolphthalein, 1(3H)-Isobenzofuranone, 3,3-bis(4-hydroxy-2,5-dimethylphenyl)-

Molecular Formula: C24H22O4Molecular Weight: 374.429080 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: PXCIPOXPHMTCIL-UHFFFAOYSA-N

• Paliperidone
IUPAC Name: (9R)-3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-9-hydroxy-2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one | CAS Registry Number: 144598-75-4
Synonyms: Invega, Invega (TN), Paliperidone (JAN/USAN/INN), CID9802545, D05339

Molecular Formula: C23H27FN4O3Molecular Weight: 426.483883 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: PMXMIIMHBWHSKN-LJQANCHMSA-N


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