Vitas-M small molecule compound
(6aS,6bR,9aS,10R)-10-[(4-methoxyphenyl)carbonyl]-8-[3-(trifluoromethyl)phenyl]-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Catalog ID
STK540082
SMILES COc1ccc(cc1)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1cccc(c1)C(F)(F)F)C=Cc1c2cccc1
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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 C29H21F3N2O4 MW 518.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21F3N2O4/c1-38-20-12-9-17(10-13-20)26(35)25-24-23(22-14-11-16-5-2-3-8-21(16)34(22)25)27(36)33(28(24)37)19-7-4-6-18(15-19)29(30,31)32/h2-15,22-25H,1H3/t22-,23-,24-,25+/m0/s1InChIKey
KZZSHKBPRZZTLR-OJJQZRKESA-NSynonyms
445462-55-5(6aS6bR9aS10R)10((4methoxyphenyl)carbonyl)8(3(trifluoromethyl)phenyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
(6aS6bR9aS10R)10(4methoxybenzoyl)8(3(trifluoromethyl)phenyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
445462555
COC1=CC=C(C=C1)C(=O)C2C3C(C4N2C5=CC=CC=C5C=C4)C(=O)N(C3=O)C6=CC=CC(=C6)C(F)(F)F
COc1ccc(cc1)C(=O)(C@@H)1N2(C@H)((C@H)3(C@@H)1C(=O)N(C3=O)c1cccc(c1)C(F)(F)F)C=Cc1c2cccc1
InChI=1SC29H21F3N2O4c1382012917(101320)26(35)252423(22141116523821(16)34(22)25)27(36)33(28(24)37)1974618(1519)29(3031)32h2152225H1H3t22232425+m0s1
MFCD18241802
ZINC000100818651
ZINC100818651
Check stock
See real-time availability and sample size for STK540082 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.