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APAC Pharmaceutical, LLC

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Contact: Andy Yao
Web: http://www.apacpharma.com
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Address: 6851 Oak Hall Lane, Suite 101, Columbia, Maryland 21045, USA
Phone: +1-(410)-997-5552, 469-0727 | Fax: +1-(410)-309-5955 | Map/Directions >>

Profile: APAC Pharmaceutical, LLC is a custom chemical and cGMP manufacturing company. We provide chemistry & manufacturing solutions for specialty chemical, pharmaceutical and bio-tech companies. Our specialty product lines are specialty intermediates, metabolites, research reference standards, and drug like compound libraries. These products represent highly characterized compounds of drug substances, impurities, degradation products, metabolites and performance calibrators. Our products include fondaparinux sodium, 2,3,0-(3-pentylidene)-d-gluceraldhyde, 4, 4 -difluoro-cyclohexane carboxylic acid, 1,3,5-tris[(3,3,3-trifluoropropyl)methyl]cyclotrisiloxane, (s)-(-)-4-benzyl-2-oxazolidinone, d-(-)-2-aminobutylic acid, and (r)-tert-butanesulfinamide. We are also specialized in the research and production of synthetic peptides. We develop and manufacture custom peptides & custom cGMP peptides. We have a wide range of modified peptides such as those with unnatural amino acid, phosphorylation, terminal modifications and cyclization. We specialize in the modification of nucleosides and nucleotides. We offer a variety of modified and non-modified nucleoside/nucleotide as well as their analogs. We manufacture a variety of aromatic and unsaturated N, O, S heterocyclic ring including heteroaromatic synthons, complex heterocyclic systems & novel heteroaromatic compounds.

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• 4-(n-Ethyl-n-cyanoethyl)amino-2-methyl benzaldehyde
IUPAC Name: 3-(N-ethyl-4-formyl-3-methylanilino)propanenitrile | CAS Registry Number: 119-97-1
Synonyms: 528315_ALDRICH, EINECS 204-362-2, ZINC01847834, 2-Methyl-N-ethyl-N-(2-cyanoethyl)-4-aminobenzaldehyde, 3-(Ethyl(4-formyl-3-methylphenyl)amino)propiononitrile, T0515-3093, Propanenitrile, 3-(ethyl(4-formyl-3-methylphenyl)amino)-

Molecular Formula: C13H16N2OMolecular Weight: 216.278940 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: VTXVKMVZEXXUIC-UHFFFAOYSA-N

• 2-Bromo-5-chloropyridine
IUPAC Name: 2-bromo-5-chloropyridine | CAS Registry Number: 40473-01-6
Synonyms: TPC-PY102, ZINC00330764, CID817098, ST5408864, TL8002944, AC-907/25004332

Molecular Formula: C5H3BrClNMolecular Weight: 192.441020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BZUUVQCSPHPUQA-UHFFFAOYSA-N

• 4-Fluoro Phenyl Sulfonyl Chloride
IUPAC Name: 4-fluorobenzenesulfonyl chloride | CAS Registry Number: 349-88-2
Synonyms: 4-Fluorobenzenesulfonyl chloride, p-Fluorobenzenesulfonyl chloride, 4-Fluorophenylsulfonyl chloride, F6206_ALDRICH, Benzenesulfonyl chloride, 4-fluoro-, Benzenesulfonyl chloride, p-fluoro-, 4-Fluorobenzenesulphonyl chloride, 46670_FLUKA, TOS-BB-1128, EINECS 206-493-0, NSC140128, NSC 140128, P-FLUOROBENZENESULPHONYL CHLORIDE

Molecular Formula: C6H4ClFO2SMolecular Weight: 194.611163 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: BFXHJFKKRGVUMU-UHFFFAOYSA-N

• 3-Bromo-5-methylpyridine
IUPAC Name: 3-bromo-5-methylpyridine | CAS Registry Number: 3430-16-8
Synonyms: 3-bromo-5-methylpyridine, 5-Bromo-3-picoline, 3-bromo-5-picoline, 5-bromo-3-methylpyridine, 3-brom-5-methylpyridin, 3-methyl-5-bromopyridine, ZINC00331876, zlchem 381, PubChem4036, AGN-PC-0DBESO, AC1LG9QR, ACMC-209i6c, SureCN315970, AC1Q25UZ, KSC497K7D, CTK3J7571, ZLC0227, MolPort-001-768-344, ACT06735, ANW-27826

Molecular Formula: C6H6BrNMolecular Weight: 172.022540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ADCLTLQMVAEBLB-UHFFFAOYSA-N

• 2-Methyl-4-nitroimidazole
IUPAC Name: 2-methyl-5-nitro-1H-imidazole | CAS Registry Number: 696-23-1
Synonyms: Menidazole, 2-Methyl-5-nitroimidazole, Imidazole, 2-methyl-4-nitro-, Imidazole, 2-methyl-5-nitro-, 5-Nitro-2-methyl imidazole, 1H-Imidazole, 2-methyl-4-nitro-, 2-Methyl-5-nitro-1H-imidazole, EINECS 211-790-3, AIDS398397, AIDS-398397, CID12760, RP 8532, STK320516, ZINC02031392, ZINC04807239, 2-METHYL-4-NITRO-1H-IMIDAZOLE, 2-Methyl-5-nitro-1H-imidazole (9CI), LS-78792, ST5331253, TL8006602

Molecular Formula: C4H5N3O2Molecular Weight: 127.101400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: FFYTTYVSDVWNMY-UHFFFAOYSA-N

• 2,3,5-Trimethylpyridine
IUPAC Name: 2,3,5-trimethylpyridine | CAS Registry Number: 695-98-7
Synonyms: 2,3,5-COLLIDINE, Pyridine, 2,3,5-trimethyl-, 513261_ALDRICH, ZINC02031394, CID12759, EINECS 211-786-1, TL8004882

Molecular Formula: C8H11NMolecular Weight: 121.179640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GFYHSKONPJXCDE-UHFFFAOYSA-N

• 2-Chloro-3'4'-dimethoxybenzil
IUPAC Name: 1-(2-chlorophenyl)-2-(3,4-dimethoxyphenyl)ethane-1,2-dione | CAS Registry Number: 56159-70-7
Synonyms: Benzil-based compound, 23, 2-Chloro-3',4'-dimethoxybenzil, 542229_ALDRICH, CHEBI:420884, MolPort-003-936-288, CID92036, Ethanedione, (2-chlorophenyl)(3,4-dimethoxyphenyl)-, 1-(2-Chlorophenyl)-2-(3,4-dimethoxyphenyl)ethane-1,2-dione, 1,2-Ethanedione, 1-(2-chlorophenyl)-2-(3,4-dimethoxyphenyl)-, 1-(2-Chloro-phenyl)-2-(3,4-dimethoxy-phenyl)-ethane-1,2-dione

Molecular Formula: C16H13ClO4Molecular Weight: 304.725020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: ULVSCSFZMZRZHJ-UHFFFAOYSA-N

• 2,5-Difluorobromobenzene
IUPAC Name: 2-bromo-1,4-difluorobenzene | CAS Registry Number: 399-94-0
Synonyms: 1-Bromo-2,5-difluorobenzene, 2-Bromo-1,4-difluorobenzene, 247952_ALDRICH, Benzene, 2-bromo-1,4-difluoro-, JRD-0410, NSC10250, EINECS 206-920-0, ZINC00160131, ST5405330, TL8002891, InChI=1/C6H3BrF2/c7-5-3-4(8)1-2-6(5)9/h1-3

Molecular Formula: C6H3BrF2Molecular Weight: 192.988826 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: XCRCSPKQEDMVBO-UHFFFAOYSA-N

• (R)-(-)-2-Chlorophenylglycine methyl ester
IUPAC Name: methyl (2R)-2-amino-2-(2-chlorophenyl)acetate | CAS Registry Number: 141109-16-2
Synonyms: PubChem6250, zlchem 1316, methyl (2R)-2-amino-2-(2-chlorophenyl)acetate, 212838-70-5, AC1Q41IS, CTK4E6361, ZLE0092, ZINC21982882, AKOS006278828, AKOS007930230, (R)-2-chlorophenylglycine methyl ester, AG-E-56038, KB-02851, (2R)-2-amino-2-(2-chlorophenyl)acetate, FT-0643323, (R)-(-)-2-chlorophenylglycine methyl ester methyl, Benzeneacetic acid, a-amino-2-chloro-, methyl ester,hydrochloride (1:1), (aR)-, Benzeneaceticacid, a-amino-2-chloro-, methyl ester,hydrochloride, (aR)-(9CI)

Molecular Formula: C9H10ClNO2Molecular Weight: 199.634200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UTWOZNRDJNWTPS-MRVPVSSYSA-N

• 4-Aminophthalic acid
IUPAC Name: 4-aminophthalic acid | CAS Registry Number: 5434-21-9
Synonyms: 4-Aminophthalate, 4-AMINO PHTHALIC ACID, ghl.PD_Mitscher_leg0.1208, 524716_ALDRICH, 4-Amino-1,2-benzenedicarboxylic acid, AIDS020104, AIDS-020104, NSC15742, EINECS 226-596-4, 1,2-Benzenedicarboxylic acid, 4-amino-, NSC 15742

Molecular Formula: C8H7NO4Molecular Weight: 181.145480 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: OXSANYRLJHSQEP-UHFFFAOYSA-N

• 2-Mercapto-5-Methoxybenzimidazole
IUPAC Name: 5-methoxy-1,3-dihydrobenzimidazole-2-thione | CAS Registry Number: 37052-78-1
Synonyms: Maybridge1_006266, MLS000083176, 5-Methoxy-2-benzimidazolethiol, 382485_ALDRICH, BB_SC-1604, EINECS 253-326-2, SBB000219, ZINC00058273, ZINC00389869, SMR000046769, TL8002732, 5-methoxy-1,3-dihydrobenzimidazole-2-thione, 5-methoxy-1H-benzimidazol-2-yl hydrosulfide, 1,3-Dihydro-5-methoxy-2H-benzimidazole-2-thione, AN-829/05700007, SR-01000534899-3, InChI=1/C8H8N2OS/c1-11-5-2-3-6-7(4-5)10-8(12)9-6/h2-4H,1H3,(H2,9,10,12

Molecular Formula: C8H8N2OSMolecular Weight: 180.226920 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: KOFBRZWVWJCLGM-UHFFFAOYSA-N

• 2-Phenyl Imidazoline
IUPAC Name: 2-phenyl-4,5-dihydro-1H-imidazole | CAS Registry Number: 936-49-2
Synonyms: 2-Phenylimidazoline, 2-Phenyl-2-imidazoline, 2-IMIDAZOLINE, 2-PHENYL-, 78727_ALDRICH, 1H-Imidazole, 4,5-dihydro-2-phenyl-, EINECS 213-313-4, NSC 54747, NSC54747, BRN 0119250, 2-Phenyl-4,5-dihydro-1H-imidazole, LS-79675, TL8005931, 5-23-06-00425 (Beilstein Handbook Reference), 170013-98-6, 54391-81-0

Molecular Formula: C9H10N2Molecular Weight: 146.189100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: BKCCAYLNRIRKDJ-UHFFFAOYSA-N

• 5-Hydroxy Indole
IUPAC Name: 1H-indol-5-ol | CAS Registry Number: 1953-54-4
Synonyms: 5-Hydroxyindole, 1H-Indol-5-ol, INDOL-5-OL, 5-Hydroxy-1H-indole, Hydroxy-5 indole, 5-Indolol, Hydroxy-5 indole [French], CCRIS 4422, NCIOpen2_001272, WLN: T56 BMJ GQ, 1H-Indol-5-ol (9CI), H31859_ALDRICH, Hydroxy-5 indole [French], MLS000039632, 5-HI, EINECS 217-782-6, NSC 87503, NSC87503, BRN 0112349, NSC-87503

Molecular Formula: C8H7NOMolecular Weight: 133.147280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: LMIQERWZRIFWNZ-UHFFFAOYSA-N

• 2,4-Difluorobromobenzene
IUPAC Name: 1-bromo-2,4-difluorobenzene | CAS Registry Number: 348-57-2
Synonyms: 1-Bromo-2,4-difluorobenzene, Benzene, 1-bromo-2,4-difluoro-, 1-Bromo-2,4-difluoro-benzene, 263443_ALDRICH, CID67674, JRD-0065, EINECS 206-479-4, TL806164, ST5405337, InChI=1/C6H3BrF2/c7-5-2-1-4(8)3-6(5)9/h1-3

Molecular Formula: C6H3BrF2Molecular Weight: 192.988826 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MGHBDQZXPCTTIH-UHFFFAOYSA-N

• 2-Chloro-3,5-dimethyl-4-methoxypyridine hydrochloride
IUPAC Name: 2-chloro-4-methoxy-3,5-dimethylpyridine;hydrochloride | CAS Registry Number: 110464-98-7
Synonyms: 2-Chloro-3,5-dimethyl-4-methoxy pyridine hydrochloride, 2-chloro-4-methoxy-3,5-dimethylpyridine hydrochloride, CTK8G5597, AKOS015911864, AC-10599, AK-55909, HC150150, KB-169472, FT-0642704, A802252, I14-38319, 2-chloranyl-4-methoxy-3,5-dimethyl-pyridine hydrochloride

Molecular Formula: C8H11Cl2NOMolecular Weight: 208.085040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: NIZFMEYAXQCDSL-UHFFFAOYSA-N

• 3-Methylthiophenylboronic Acid
IUPAC Name: (3-methylsulfanylphenyl)boronic acid | CAS Registry Number: 128312-11-8
Synonyms: 3-(Methylthio)phenylboronic acid, 3-(Methylthio)benzeneboronic Acid, 3-methylthiobenzeneboronic acid, 3-(Meththio)phenylboronic acid, 3-(Methylthio)phenyl-boronic acid, 3-(methylsulfanyl)phenylboronic acid, [3-(methylsulfanyl)phenyl]boranediol, (3-methylsulfanylphenyl)boronic Acid, PubChem1789, ACMC-1CDY5, 3-BORONOTHIOANISOLE, SureCN133330, AC1MC10F, AC1Q4GX1, KSC489K7T, 3-Methylthiophenylboronic acid,, 526002_ALDRICH, Jsp001761, CTK3I9579, MolPort-000-139-854

Molecular Formula: C7H9BO2SMolecular Weight: 168.021160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: TYVPOLHSKGEXIH-UHFFFAOYSA-N

• 2,4-Dihydroxy-6,7-Dimethoxyquinazoline
IUPAC Name: 6,7-dimethoxy-1H-quinazoline-2,4-dione | CAS Registry Number: 28888-44-0
Synonyms: Oprea1_517280, 329258_ALDRICH, 6,7-Dimethoxyquinazoline-2,4-dione, BB_NC-0679, EINECS 249-288-1, 6,7-Dimethoxy-2,4-quinazolinedione, CID120081, ZINC00120622, NCGC00160264-01, 6,7-Dimethoxyquinazoline-2,4(1H,3H)-dione, ST5307686, TL8002279, 6,7-Dimethoxy-2,4(1H,3H)-quinazolinedione

Molecular Formula: C10H10N2O4Molecular Weight: 222.197400 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: KWNQIIMVPSMYEM-UHFFFAOYSA-N

• 2-Fluoro-4-hydroxybenzoic acid
IUPAC Name: 2-fluoro-4-hydroxybenzoic acid | CAS Registry Number: 65145-13-3
Synonyms: 2-Fluoro-4-hydroxybenzoic Acid, 2-fluoro-4-hydroxy-benzoic Acid, SBB051451, PubChem2608, AC1MD4FW, ACMC-1B9JP, SureCN311907, FRINTON FR-2445, KSC352Q5P, RARECHEM AL BO 0814, CTK2F2857, NXWTWYULZRDBSA-UHFFFAOYSA-, MolPort-001-778-504, Benzoicacid, 2-fluoro-4-hydroxy-, ACN-S003584, ACT00563, ANW-34991, AKOS005259825, AC-3958, AG-G-44935

Molecular Formula: C7H5FO3Molecular Weight: 156.111203 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: NXWTWYULZRDBSA-UHFFFAOYSA-N

• 2-Hydroxy-6-Chloroquinoxaline
IUPAC Name: 6-chloro-1H-quinoxalin-2-one | CAS Registry Number: 2427-71-6
Synonyms: 2(1H)-Quinoxalinone, 6-chloro-, 39267-06-6

Molecular Formula: C8H5ClN2OMolecular Weight: 180.591100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: SJAZZQLTKBYDHN-UHFFFAOYSA-N

• 4-Nitrophthalic Acid
IUPAC Name: 4-nitrophthalic acid | CAS Registry Number: 610-27-5
Synonyms: 4-Nitrophthalic acid, 5-Nitrophthalic acid, Phthalic acid, 4-nitro-, 274755_ALDRICH, 73775_FLUKA, NSC5395, 1,2-Benzenedicarboxylic acid, 4-nitro-, AIDS019416, BB_SC-0186, AIDS-019416, NSC 5395, EINECS 210-215-3, AI3-08820, ST5307575, InChI=1/C8H5NO6/c10-7(11)5-2-1-4(9(14)15)3-6(5)8(12)13/h1-3H,(H,10,11)(H,12,13

Molecular Formula: C8H5NO6Molecular Weight: 211.128400 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: SLBQXWXKPNIVSQ-UHFFFAOYSA-N

• 2-Nonanone
IUPAC Name: nonan-2-one | CAS Registry Number: 821-55-6
Synonyms: 2-NONANONE, Heptyl methyl ketone, Nonan-2-one, beta-Nonanone, Methyl heptyl ketone, Ketone, heptyl methyl, .beta.-Nonanone, 2-Nonanone (natural), METHYL N-HEPTYL KETONE, FEMA No. 2785, n-HEPTYL METHYL KETONE, W278505_ALDRICH, W278513_ALDRICH, 108731_ALDRICH, WLN: 7V1, 52000_FLUKA, 63969_FLUKA, EINECS 212-480-0, NSC 14760, NSC14760

Molecular Formula: C9H18OMolecular Weight: 142.238620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: VKCYHJWLYTUGCC-UHFFFAOYSA-N

• 2-Amino-p-cresol
IUPAC Name: 2-amino-4-methylphenol | CAS Registry Number: 95-84-1
Synonyms: 2-Amino-4-methylphenol, 6-Hydroxy-m-toluidine, p-Cresol, 2-amino-, 3-Amino-4-hydroxytoluene, 4-Methyl-2-aminophenol, 2-Hydroxy-5-methylaniline, 5-Methyl-2-hydroxyaniline, Phenol, 2-amino-4-methyl-, Ambap3038, O-AMINO-P-CRESOL, CCRIS 4581, 144908_ALDRICH, p-Cresol, 2-amino- (8CI), EINECS 202-457-3, CID7264, NSC7630, NSC 60737, AIDS019904, AIDS-019904, CPD-7366

Molecular Formula: C7H9NOMolecular Weight: 123.152460 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: ZMXYNJXDULEQCK-UHFFFAOYSA-N

• 4-Amino-2-Methyl-10-H Thieno (2,3b)(1,5)-Benzodiazapin
IUPAC Name: 2-methyl-5H-thieno[3,2-c][1,5]benzodiazepin-4-amine;hydrochloride | CAS Registry Number: 138564-60-0
Synonyms: 4-Amino-2-methyl-10H-thiene[2,3-b][1,5]benzodiazepine hydrochloride, 4-Amino-2-methyl-10H-thieno[2,3-b][1,5] benzodiazapine HCl, 2-Methyl-10H-benzo[b]thieno[2,3-e][1,4]diazepin-4-amine hydrochloride, 2-methyl-10H-benzo[b]thiopheno[3,2-f]1,4-diazepine-4-ylamine, chloride, SureCN937256, AGN-PC-00EA9V, CTK6C5841, MolPort-000-854-397, BB_SC-4610, SBB001030, AKOS000277837, AC-5499, AG-A-71353, MCULE-1167350983, RP29462, AK-25403, BR-25403, ST060217, AB1008597, TL8006140

Molecular Formula: C12H12ClN3SMolecular Weight: 265.761780 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: FYWKZVBFQWWTHT-UHFFFAOYSA-N

• 5-Amino-2-chloropyridine
IUPAC Name: 6-chloropyridin-3-amine | CAS Registry Number: 5350-93-6
Synonyms: NSC81, 2-Chloro-5-aminopyridine, 3-Amino-6-chloropyridine, 6-chloropyridin-3-ylamine, 3-Pyridinamine, 6-chloro-, TPC-PY039, 188778_ALDRICH, CID79305, EINECS 226-322-3, SBB004234, ZINC00331618, A139, TL806260, AC-907/25014053, InChI=1/C5H5ClN2/c6-5-2-1-4(7)3-8-5/h1-3H,7H

Molecular Formula: C5H5ClN2Molecular Weight: 128.559600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QAJYCQZQLVENRZ-UHFFFAOYSA-N

• 2-Methoxy-6-methylaminopyridine
IUPAC Name: 6-methoxy-N-methylpyridin-2-amine | CAS Registry Number: 88569-83-9
Synonyms: Ambap2289, 2-Methoxy-6-(methylamino)pyridine, M131, TL806337

Molecular Formula: C7H10N2OMolecular Weight: 138.167100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GXHQLRBOZRJHPZ-UHFFFAOYSA-N

• 2-Bromo 5 Methyl Pyridine
IUPAC Name: 2-bromo-5-methylpyridine | CAS Registry Number: 3510-66-5
Synonyms: 2-Bromo-5-methylpyridine, 6-Bromo-3-picoline, Ambap5280, Pyridine, 2-bromo-5-methyl-, 2-Bromo-5-Methyl Pyridine, TPC-PY066, 263354_ALDRICH, ZINC00409192, B210, TL8002615, InChI=1/C6H6BrN/c1-5-2-3-6(7)8-4-5/h2-4H,1H

Molecular Formula: C6H6BrNMolecular Weight: 172.022540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: YWNJQQNBJQUKME-UHFFFAOYSA-N

• 2-Mercaptobenzothiazole
IUPAC Name: 3H-1,3-benzothiazole-2-thione | CAS Registry Number: 149-30-4
Synonyms: Captax, Sulfadene, Dermacid, Thiotax, Kaptax, Mertax, Rotax, Accelerator M, Mebetizole, Mebithizol, Kaptaks, Vulkacit M, Benzothiazolethiol, Rokon, Ekagom G, mebetizol, Accel M, 2-Benzothiazolethiol, Soxinol M, Vulkacit Mercapto

Molecular Formula: C7H5NS2Molecular Weight: 167.251300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 0

InChIKey: YXIWHUQXZSMYRE-UHFFFAOYSA-N

• 4-(n-Methyl-n-chloroethyl)amino benzaldehyde
IUPAC Name: 4-[2-chloroethyl(methyl)amino]benzaldehyde | CAS Registry Number: 94-31-5
Synonyms: EINECS 202-321-3, p-((2-Chloroethyl)methylamino)benzaldehyde, 4-((2-Chloroethyl)methylamino)benzaldehyde, Benzaldehyde, 4-((2-chloroethyl)methylamino)-

Molecular Formula: C10H12ClNOMolecular Weight: 197.661380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: IYFULQJDHJGQKQ-UHFFFAOYSA-N

• 6-Hydroxy-2,4,5-Triaminopyrimidine
IUPAC Name: 2,5,6-triamino-1H-pyrimidin-4-one | CAS Registry Number: 1004-75-7
Synonyms: ChemDiv1_000151, 2,4,5-Triamino-6-pyrimidinol, 2,5,6-Triamino-4-pyrimidinol, 2,5,6-Triamino-4-oxopyrimidine, 2,5,6-Triaminopyrimidin-4-ol, 2,4,5-Triamino-6-oxypyrimidine, 2,5,6-Triamino-4-pyrimidol, 6-Hydroxy-2,4,5-triaminopyrimidine, 2,4,5-Triaminopyrimidin-6(1H)-one, 4(1H)-Pyrimidinone, 2,5,6-triamino-, NSC 9313, 2,5,6-Triamino-4-pyrimidinone, EINECS 213-725-4, 2,4,5-Triamino-6-hydroxypyrimidine, NSC9313, AIDS019723, 2,5,6-Triamino-4(1H)-pyrimidinone, AIDS-019723, EINECS 254-393-0, ZINC01699914

Molecular Formula: C4H7N5OMolecular Weight: 141.131280 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 5

InChIKey: SYEYEGBZVSWYPK-UHFFFAOYSA-N

• 2-Mercaptan Benzamidazole
IUPAC Name: 1,3-dihydrobenzimidazole-2-thione | CAS Registry Number: 583-39-1
Synonyms: Antiegene MB, 2-Mercaptobenzimidazole, 2-Benzimidazolethiol, Antioxidant MB, Antigene MB, Antigen MB, o-Phenylenethiourea, Benzimidazolethiol, Permanax 21, 2-Thiobenzimidazole, Mercaptobenzimidazole, Mercaptobenzoimidazole, Anitiegene MB, AOMB, 2-Thiol benzimidazole, 2-Benzimidazolinethione, ASM MB, Merkaptobenzimidazol, 1H-Benzimidazole-2-thiol, Benzimidazole-2-thiol

Molecular Formula: C7H6N2SMolecular Weight: 150.200940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 0

InChIKey: YHMYGUUIMTVXNW-UHFFFAOYSA-N

• 3-hydroxy-phthalicanhydrid
IUPAC Name: 4-hydroxy-2-benzofuran-1,3-dione | CAS Registry Number: 37418-88-5
Synonyms: 3-Hydroxyphthalic anhydride, Phthalic anhydride, 3-hydroxy-, 3-Hydroxyphthalic acid anhydride, 1,3-Isobenzofurandione, 4-hydroxy-, 308021_ALDRICH, NSC 80858, AIDS189613, AIDS189633, AIDS189634, AIDS189665, AIDS189666, AIDS189667, AIDS189669, AIDS189670, AIDS189671, AIDS189672, AIDS189673, 4-hydroxy-2-benzofuran-1,3-dione, 4-Hydroxy-isobenzofuran-1,3-dione, AIDS-189613

Molecular Formula: C8H4O4Molecular Weight: 164.114960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: CCTOEAMRIIXGDJ-UHFFFAOYSA-N

• 3-Cyano-2,6-dihydroxy-5-fluoropyridine
IUPAC Name: 5-fluoro-6-hydroxy-2-oxo-1H-pyridine-3-carbonitrile | CAS Registry Number: 113237-18-6
Synonyms: 2,6-Dihydroxy-5-fluoro-3-cyanopyridine, 5-fluoro-2,6-dihydroxypyridine-3-carbonitrile, 5-fluoro-2,6-dihydroxynicotinonitrile, 3-cyano-2,6-dihydroxy-5-fluoropyridine, AN-668/25093007, 3-Pyridinecarbonitrile,5-fluoro-1,2-dihydro-6-hydroxy-2-oxo-, ACMC-1BVQT, AC1LGEK7, SureCN3686316, SureCN7903836, Jsp001030, CTK4A8159, MolPort-003-802-979, SBB065257, AKOS006277485, AG-D-32922, AC-11751, KB-31380, 2,6-Dihydroxy-5-fluoro-3-cyano-pyridine, 3-Cyano-2,6-dihydroxy-5-fluoropyridine;

Molecular Formula: C6H3FN2O2Molecular Weight: 154.098623 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: JWNUZZLUDDUXPO-UHFFFAOYSA-N

• 2-Amino-3-Chloro Benzoic Acid
IUPAC Name: 2-amino-3-chlorobenzoic acid | CAS Registry Number: 6388-47-2
Synonyms: 2-Amino-3-chlorobenzoic acid, 3-Chloroanthranilic acid, Anthranilic acid, 3-chloro-, 362271_ALDRICH, Benzoic acid, 2-amino-3-chloro-, NSC20671, EINECS 228-996-4, SBB003844, TL8007342, InChI=1/C7H6ClNO2/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3H,9H2,(H,10,11

Molecular Formula: C7H6ClNO2Molecular Weight: 171.581040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: LWUAMROXVQLJKA-UHFFFAOYSA-N

• 3-Amino-5-methylbenzotrifluoride
IUPAC Name: 3-methyl-5-(trifluoromethyl)aniline | CAS Registry Number: 96100-12-8
Synonyms: 3-methyl-5-thifluoromethylaniline, ZINC02382276, CID2737713, TL8006004

Molecular Formula: C8H8F3NMolecular Weight: 175.151030 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: WYDJMBLMXGCHOL-UHFFFAOYSA-N

• 4,6-Dichloropyridine-3-carboxylic acid
IUPAC Name: 4,6-dichloropyridine-3-carboxylic acid | CAS Registry Number: 73027-79-9
Synonyms: 4,6-dichloronicotinic acid, 4,6-DICHLORO NICOTINIC ACID, 2,4-Dichloro-5-carboxylpyridine, 2,4-dichloropyridine-5-carboxylic acid, 2,4-Dichloro-5-carboxypyridine, AC-907/25004487, PubChem18521, AC1LG8IR, AC1Q3KZY, ACMC-209op3, KSC376S3P, CTK2H6937, MolPort-000-140-180, BH376, ACN-S004235, ACT02434, AC-963, ANW-36277, AR-1F8637, FC0401

Molecular Formula: C6H3Cl2NO2Molecular Weight: 191.999520 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ILMIEWNDXAKVNI-UHFFFAOYSA-N

• 5-Nitro-2-thiophenecarboxylic acid
IUPAC Name: 5-nitrothiophene-2-carboxylic acid | CAS Registry Number: 6317-37-9
Synonyms: 5-Nitro-2-thenoic acid, N6898_SIGMA, NSC41707, 5-Nitrothiophene-2-carboxylic acid, CID80591, EINECS 228-654-4, RF 01631, TL8004391

Molecular Formula: C5H3NO4SMolecular Weight: 173.146620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: UNEPVPOHGXLUIR-UHFFFAOYSA-N

• 3,5-Dichloro Benzonitrile
IUPAC Name: 3,5-dichlorobenzonitrile | CAS Registry Number: 6575-00-4
Synonyms: 3,5-Dichlorobenzonitrile, Benzonitrile, 3,5-dichloro-, 139394_ALDRICH, EINECS 229-495-3, NSC109596, ZINC00159427, AI3-34463, ST5308522, TL8004663, InChI=1/C7H3Cl2N/c8-6-1-5(4-10)2-7(9)3-6/h1-3

Molecular Formula: C7H3Cl2NMolecular Weight: 172.011420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: PUJSUOGJGIECFQ-UHFFFAOYSA-N

• 3,4,5-Trimethoxybenzaldehyde
IUPAC Name: 3,4,5-trimethoxybenzaldehyde | CAS Registry Number: 86-81-7
Synonyms: 3,4,5-TRIMETHOXYBENZALDEHYDE, Benzaldehyde, 3,4,5-trimethoxy-, T68403_ALDRICH, 92140_FLUKA, EINECS 201-701-6, BENZALDEHYDE,3,4,5-TRIMETHOXY-, NSC 16692, AIDS017928, AIDS-017928, NSC16692, BRN 0395163, SBB016338, ZINC02504375, AI3-36673, LS-25170, TL8005630, 4-08-00-02719 (Beilstein Handbook Reference), InChI=1/C10H12O4/c1-12-8-4-7(6-11)5-9(13-2)10(8)14-3/h4-6H,1-3H

Molecular Formula: C10H12O4Molecular Weight: 196.199880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: OPHQOIGEOHXOGX-UHFFFAOYSA-N

• 3-Methoxysalicylic acid
IUPAC Name: 2-hydroxy-3-methoxybenzoic acid | CAS Registry Number: 877-22-5
Synonyms: o-Vanillic acid, Acide orthovanillique, 3-Hydroxy-m-anisic acid, 2-Hydroxy-3-methoxybenzoic acid, m-Anisic acid, 2-hydroxy-, WLN: QVR BQ CO1, Benzoic acid, 2-hydroxy-3-methoxy-, 196495_ALDRICH, 55546_FLUKA, EINECS 212-888-9, AIDS018088, NSC 134533, NSC 408167, AIDS-018088, BRN 2209642, NSC134533, NSC408167, LS-20097, ST5406420, Benzoic acid, 2-hydroxy-3-methoxy- (9CI)

Molecular Formula: C8H8O4Molecular Weight: 168.146720 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: AUZQQIPZESHNMG-UHFFFAOYSA-N

• (-)-Securinine
Synonyms: Securinine, Virosecurinine, Securinin, Securinan-11-one, Securinine, (-)-, Spectrum2_000669, Spectrum3_001977, UPCMLD-DP039, BSPBio_003577, SPECTRUM1505334, SPBio_000737, UPCMLD-DP039:001, KBio3_002957, AIDS002233, AIDS-002233, NSC107413, NSC107414, SBB005941, NCGC00142506-01, NCGC00142506-03

Molecular Formula: C13H15NO2Molecular Weight: 217.263700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: SWZMSZQQJRKFBP-WZRBSPASSA-N

• 2-methyl-oxazole-4-carboxylic Aicd Methyl Ester
IUPAC Name: methyl 2-methyl-1,3-oxazole-4-carboxylate | CAS Registry Number: 85806-67-3
Synonyms: methyl 2-methyloxazole-4-carboxylate, 2-Methyl-oxazole-4-carboxylic acid methyl ester, methyl 2-methyl-1,3-oxazole-4-carboxylate, Methyl-4-methyl-3,5-oxazolecarboxylate, AG-H-45989, 2-Methyl-oxazole-4-carboxylicacidmethylester, 4-(Methoxycarbonyl)-2-methyl-1,3-oxazole, 2-methyl-1,3-oxazole-4-carboxylic acid methyl ester, 4-OXAZOLECARBOXYLIC ACID, 2-METHYL-, METHYL ESTER, PubChem11666, AGN-PC-0CUHSF, SureCN286492, CTK5F5772, MolPort-002-499-395, ANW-52560, SBB086182, ZINC02507134, AKOS006339865, methyl-2-methyl oxazole-4-carboxylate, AB13936

Molecular Formula: C6H7NO3Molecular Weight: 141.124680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: NBBUIANVONUUEM-UHFFFAOYSA-N

• 4-bromo-2-(chloromethyl)-1-methoxybenzene
IUPAC Name: 4-bromo-2-(chloromethyl)-1-methoxybenzene | CAS Registry Number: 7017-52-9
Synonyms: 4-BROMO-2-(CHLOROMETHYL)-1-METHOXYBENZENE, 5-bromo-2-methoxybenzylchloride, 4-Bromo-2-chloromethyl-1-methoxy-benzene, SureCN7975482, CTK2H5207, MolPort-005-229-563, ZINC20369928, AKOS007930056, AB44028, AG-G-73939, AG-L-25420, AC-10870, KB-42113, AB1007663, KB-240532, Benzene, 4-bromo-2-(chloromethyl)-1-methoxy-

Molecular Formula: C8H8BrClOMolecular Weight: 235.505520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: YUJFMJVATVQTBS-UHFFFAOYSA-N

• 3,4-Dichloroaniline
IUPAC Name: 3,4-dichloroaniline | CAS Registry Number: 95-76-1
Synonyms: 3,4-DICHLOROANILINE, 3,4-Dichloranilin, 4,5-Dichloroaniline, 3,4-Dichloraniline, 3,4-Dichlorobenzenamine, Benzenamine, 3,4-dichloro-, m.p-Dichloroaniline, Aniline, 3,4-dichloro-, m,p-dichloroaniline, 3,4-Dichlorophenylamine, 1-Amino-3,4-dichlorobenzene, 3,4-DCA, DCA (VAN), WLN: ZR CG DG, 34-DICHLOROANILINE, 4-Amino-1,2-dichlorobenzene, CCRIS 2395, nchembio.2007.32-comp5, HSDB 1319, MLS002152880

Molecular Formula: C6H5Cl2NMolecular Weight: 162.016600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: SDYWXFYBZPNOFX-UHFFFAOYSA-N

• 2,6-Dichlorophenylacetic acid
IUPAC Name: 2-(2,6-dichlorophenyl)acetic acid | CAS Registry Number: 6575-24-2
Synonyms: 259241_ALDRICH, Benzeneacetic acid, 2,6-dichloro-, EINECS 229-504-0, SBB003503, 2,6-DICHLOROPHENYL ACETIC ACID, InChI=1/C8H6Cl2O2/c9-6-2-1-3-7(10)5(6)4-8(11)12/h1-3H,4H2,(H,11,12, 2CL

Molecular Formula: C8H6Cl2O2Molecular Weight: 205.038040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: SFAILOOQFZNOAU-UHFFFAOYSA-N

• 2',4'-Difluoroacetophenone
IUPAC Name: 1-(2,4-difluorophenyl)ethanone | CAS Registry Number: 364-83-0
Synonyms: Acetophenone, 2',4'-difluoro-, 264253_ALDRICH, Ethanone, 1-(2,4-difluorophenyl)-, 36863_FLUKA, ZINC00157303, CID67770, EINECS 206-667-6, 1-(2,4-Difluorophenyl)ethan-1-one, TL806298, T5792202

Molecular Formula: C8H6F2OMolecular Weight: 156.129446 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QEWHNJPLPZOEKU-UHFFFAOYSA-N

• 3,5-Dimethoxy Benzamide
IUPAC Name: 3,5-dimethoxybenzamide | CAS Registry Number: 17213-58-0
Synonyms: 3,5-Dimethoxybenzamide, Benzamide, 3,5-dimethoxy-, Oprea1_549641, D131202_ALDRICH, AIDS018407, AIDS-018407, NSC16615, EINECS 241-257-0, ZINC00161726, ST5406388, TL8001354, InChI=1/C9H11NO3/c1-12-7-3-6(9(10)11)4-8(5-7)13-2/h3-5H,1-2H3,(H2,10,11

Molecular Formula: C9H11NO3Molecular Weight: 181.188540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: YTLRWVNYANKXOW-UHFFFAOYSA-N

• 5-Methoxyisophthalic acid
IUPAC Name: 2-methoxybenzene-1,3-dicarboxylic acid | CAS Registry Number: 1951-38-8
Synonyms: 2-Methoxyisophthalic acid, AG-E-42626, 2-methoxybenzene-1,3-dicarboxylic Acid, AC1NCH4O, SureCN39857, 273430_ALDRICH, CTK0G9498, AKOS015894439, KB-25021, I04-9080

Molecular Formula: C9H8O5Molecular Weight: 196.156820 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: ZRWAPLTWCQQSAN-UHFFFAOYSA-N

• 4-Bromobenzocyclobutene
IUPAC Name: 4-bromobicyclo[4.2.0]octa-1(6),2,4-triene | CAS Registry Number: 1073-39-8
Synonyms: 3-bromobicyclo[4.2.0]octa-1,3,5-triene, 3-Bromo-bicyclo[4.2.0]octa-1,3,5-triene, SureCN13594, 4-BROMO-BENZOCYCLOBUTANE, MolPort-005-932-665, AC-157, ANW-50156, AKOS006290829, AK-54784, BR-54784, L661, AM20020174, Bicyclo[4.2.0]octa-1,3,5-triene, 3-bromo-

Molecular Formula: C8H7BrMolecular Weight: 183.045180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: GMHHTGYHERDNLO-UHFFFAOYSA-N

• 2-Chloro-4,6-Dimethoxy Pyrimidine
IUPAC Name: 2-chloro-4,6-dimethylpyrimidine | CAS Registry Number: 4472-44-0
Synonyms: 2-Chloro-4,6-dimethylpyrimidine, NSC49016, NSC 49016, PYRIMIDINE, 2-CHLORO-4,6-DIMETHYL-, CID20550, BRN 0110697, ZINC01529072, LS-134909, ST5160455, 5-23-05-00401 (Beilstein Handbook Reference), AF-399/25039008

Molecular Formula: C6H7ClN2Molecular Weight: 142.586180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RZVPFDOTMFYQHR-UHFFFAOYSA-N

• 2-Bromomethyl-6-Pyridine Carboxylic Acid Methyl Ester
IUPAC Name: methyl 6-(bromomethyl)pyridine-2-carboxylate | CAS Registry Number: 146462-25-1
Synonyms: Methyl 6-(bromomethyl)picolinate, 2-Bromomethyl-6-pyridine carboxylic acid methyl ester, Methyl 2-bromomethyl-6-pyridinecarboxylate, 2-BROMOMETHYL-6-PYRIDINECARBOXYLIC ACID METHYL ESTER, ACMC-209ylh, SureCN1181244, Jsp002702, CTK0H3330, MolPort-005-932-956, AC-181, ANW-49107, ZINC02507102, AKOS008901281, AB13868, AG-D-90841, RP27865, AK-29873, BR-29873, AB1007143, KB-169098

Molecular Formula: C8H8BrNO2Molecular Weight: 230.058620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: GLLACFRFEBEMED-UHFFFAOYSA-N


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