Vitas-M small molecule compound
(6aS,6bR,9aS,10R)-10-[(3-bromo-4-methoxyphenyl)carbonyl]-8-(4-fluorophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Catalog ID
STK547864
SMILES COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1)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 C28H20BrFN2O4 MW 547.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20BrFN2O4/c1-36-22-13-7-16(14-19(22)29)26(33)25-24-23(21-12-6-15-4-2-3-5-20(15)32(21)25)27(34)31(28(24)35)18-10-8-17(30)9-11-18/h2-14,21,23-25H,1H3/t21-,23-,24-,25+/m0/s1InChIKey
DENQBTIWMONPDN-BELIEFIBSA-NSynonyms
957044-98-3(6aS6bR9aS10R)10((3bromo4methoxyphenyl)carbonyl)8(4fluorophenyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
(6aS6bR9aS10R)10(3bromo4methoxybenzoyl)8(4fluorophenyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
957044983
COC1=C(C=C(C=C1)C(=O)C2C3C(C4N2C5=CC=CC=C5C=C4)C(=O)N(C3=O)C6=CC=C(C=C6)F)Br
COc1ccc(cc1Br)C(=O)(C@@H)1N2(C@H)((C@H)3(C@@H)1C(=O)N(C3=O)c1ccc(cc1)F)C=Cc1c2cccc1
InChI=1SC28H20BrFN2O4c1362213716(1419(22)29)26(33)252423(2112615423520(15)32(21)25)27(34)31(28(24)35)1810817(30)91118h214212325H1H3t21232425+m0s1
MFCD18242376
ZINC000100867274
ZINC100867274
Check stock
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Check stock on Vitas-MAvailable files
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