Vitas-M small molecule compound

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

Catalog ID
STK335289
SMILES COc1cc(ccc1OC)[C@@H]1CC(=O)C2=C(C1)Nc1c([C@H]2c2ccc(cc2)N(C)C)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 C32H32N4O4 MW 536.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32N4O4/c1-35(2)22-13-10-19(11-14-22)28-29-24(33-31-30(28)32(38)36(34-31)23-8-6-5-7-9-23)16-21(17-25(29)37)20-12-15-26(39-3)27(18-20)40-4/h5-15,18,21,28,33-34H,16-17H2,1-4H3/t21-,28-/m0/s1
InChIKey
AJOYEPAQKDBFFA-KMRXNPHXSA-N
Synonyms

(4S7S)7(34dimethoxyphenyl)4(4(dimethylamino)phenyl)2phenyl146789hexahydropyrazolo(34b)quinoline35dione
(4S7S)7(34dimethoxyphenyl)4(4(dimethylamino)phenyl)2phenyl4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
CN(C)C1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC(=C(C=C4)OC)OC)NC5=C2C(=O)N(N5)C6=CC=CC=C6
COc1cc(ccc1OC)(C@@H)1CC(=O)C2=C(C1)Nc1c((C@H)2c2ccc(cc2)N(C)C)c(=O)n((nH)1)c1ccccc1
InChI=1SC32H32N4O4c135(2)22131019(111422)282924(333130(28)32(38)36(3431)238657923)1621(1725(29)37)20121526(393)27(1820)404h5151821283334H1617H214H3t2128m0s1
MFCD13368798
ZINC000102052712
ZINC102052712

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Available files

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