Vitas-M small molecule compound

(4S,7S)-4-(2,4-dichlorophenyl)-7-(3,4-dimethoxyphenyl)-2-phenyl-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione

Catalog ID
STK335263
SMILES COc1ccc(cc1OC)[C@@H]1CC(=O)C2=C(C1)Nc1c([C@H]2c2ccc(cc2Cl)Cl)c(=O)n([nH]1)c1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C30H25Cl2N3O4 MW 562.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25Cl2N3O4/c1-38-24-11-8-16(14-25(24)39-2)17-12-22-27(23(36)13-17)26(20-10-9-18(31)15-21(20)32)28-29(33-22)34-35(30(28)37)19-6-4-3-5-7-19/h3-11,14-15,17,26,33-34H,12-13H2,1-2H3/t17-,26-/m0/s1
InChIKey
BJBUJJBVJOZCMQ-QLXKLKPCSA-N
Synonyms

(4S7S)4(24dichlorophenyl)7(34dimethoxyphenyl)2phenyl146789hexahydropyrazolo(34b)quinoline35dione
(4S7S)4(24dichlorophenyl)7(34dimethoxyphenyl)2phenyl4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
COC1=C(C=C(C=C1)C2CC3=C(C(C4=C(N3)NN(C4=O)C5=CC=CC=C5)C6=C(C=C(C=C6)Cl)Cl)C(=O)C2)OC
COc1ccc(cc1OC)(C@@H)1CC(=O)C2=C(C1)Nc1c((C@H)2c2ccc(cc2Cl)Cl)c(=O)n((nH)1)c1ccccc1
InChI=1SC30H25Cl2N3O4c1382411816(1425(24)392)17122227(23(36)1317)26(2010918(31)1521(20)32)2829(3322)3435(30(28)37)196435719h311141517263334H1213H212H3t1726m0s1
MFCD13368778
ZINC000102052577
ZINC102052577

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Available files

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