Vitas-M small molecule compound
(6aR,6bS,9aR,10S)-8-(3,5-dichlorophenyl)-10-[(4-methoxyphenyl)carbonyl]-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Catalog ID
STK542385
SMILES COc1ccc(cc1)C(=O)[C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1cc(Cl)cc(c1)Cl)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 C28H20Cl2N2O4 MW 519.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20Cl2N2O4/c1-36-20-9-6-16(7-10-20)26(33)25-24-23(22-11-8-15-4-2-3-5-21(15)32(22)25)27(34)31(28(24)35)19-13-17(29)12-18(30)14-19/h2-14,22-25H,1H3/t22-,23-,24-,25+/m1/s1InChIKey
HALJDKGQJZICRY-VPBXCIAMSA-NSynonyms
1014062-33-9(6aR6bS9aR10S)8(35dichlorophenyl)10((4methoxyphenyl)carbonyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
(6aR6bS9aR10S)8(35dichlorophenyl)10(4methoxybenzoyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
1014062339
COC1=CC=C(C=C1)C(=O)C2C3C(C4N2C5=CC=CC=C5C=C4)C(=O)N(C3=O)C6=CC(=CC(=C6)Cl)Cl
COc1ccc(cc1)C(=O)(C@H)1N2(C@@H)((C@@H)3(C@H)1C(=O)N(C3=O)c1cc(Cl)cc(c1)Cl)C=Cc1c2cccc1
InChI=1SC28H20Cl2N2O4c136209616(71020)26(33)252423(2211815423521(15)32(22)25)27(34)31(28(24)35)191317(29)1218(30)1419h2142225H1H3t22232425+m1s1
MFCD18241992
ZINC000100905368
ZINC100905368
Check stock
See real-time availability and sample size for STK542385 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.