Vitas-M small molecule compound
4-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-8-(trifluoromethyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Catalog ID
STL259615
SMILES COc1cc(cc(c1OCc1ccccc1)Br)C1Nc2ccc(cc2C2C1CC=C2)C(F)(F)F
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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 C27H23BrF3NO2 MW 530.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23BrF3NO2/c1-33-24-13-17(12-22(28)26(24)34-15-16-6-3-2-4-7-16)25-20-9-5-8-19(20)21-14-18(27(29,30)31)10-11-23(21)32-25/h2-8,10-14,19-20,25,32H,9,15H2,1H3InChIKey
ISEOVNFCPGGJHS-UHFFFAOYSA-NSynonyms
4(3BROMO5METHOXY4PHENYLMETHOXYPHENYL)8(TRIFLUOROMETHYL)3A459BTETRAHYDRO3HCYCLOPENTA(C)QUINOLINE
4(4(benzyloxy)3bromo5methoxyphenyl)8(trifluoromethyl)3a459btetrahydro3Hcyclopenta(c)quinoline
COC1=C(C(=CC(=C1)C2C3CC=CC3C4=C(N2)C=CC(=C4)C(F)(F)F)Br)OCC5=CC=CC=C5
InChI=1SC27H23BrF3NO2c133241317(1222(28)26(24)3415166324716)252095819(20)211418(27(2930)31)101123(21)3225h28101419202532H915H21H3
MFCD04091446
ZINC000002179371
ZINC000229975452
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