Vitas-M small molecule compound

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

Catalog ID
STK335309
SMILES COc1ccc(cc1OC)[C@@H]1CC(=O)C2=C(C1)Nc1c([C@H]2c2ccccc2)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 C30H27N3O4 MW 493.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N3O4/c1-36-24-14-13-19(17-25(24)37-2)20-15-22-27(23(34)16-20)26(18-9-5-3-6-10-18)28-29(31-22)32-33(30(28)35)21-11-7-4-8-12-21/h3-14,17,20,26,31-32H,15-16H2,1-2H3/t20-,26-/m0/s1
InChIKey
GNYZMRPPKNZOPJ-FNZWTVRRSA-N
Synonyms

(4S7S)7(34dimethoxyphenyl)24diphenyl146789hexahydropyrazolo(34b)quinoline35dione
(4S7S)7(34dimethoxyphenyl)24diphenyl4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
COC1=C(C=C(C=C1)C2CC3=C(C(C4=C(N3)NN(C4=O)C5=CC=CC=C5)C6=CC=CC=C6)C(=O)C2)OC
COc1ccc(cc1OC)(C@@H)1CC(=O)C2=C(C1)Nc1c((C@H)2c2ccccc2)c(=O)n((nH)1)c1ccccc1
InChI=1SC30H27N3O4c13624141319(1725(24)372)20152227(23(34)1620)26(1895361018)2829(3122)3233(30(28)35)21117481221h3141720263132H1516H212H3t2026m0s1
MFCD13368805
ZINC000018198613
ZINC18198613

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Available files

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