Vitas-M small molecule compound
6-({4-[bis(4-fluorophenyl)methyl]piperazin-1-yl}methyl)-8-methoxy-4,4-dimethyl-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
Catalog ID
STL482637
SMILES COc1cc2C(=CC(N3c2c(c1)C(=O)C3=O)(C)C)CN1CCN(CC1)C(c1ccc(cc1)F)c1ccc(cc1)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 C32H31F2N3O3 MW 543.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31F2N3O3/c1-32(2)18-22(26-16-25(40-3)17-27-29(26)37(32)31(39)30(27)38)19-35-12-14-36(15-13-35)28(20-4-8-23(33)9-5-20)21-6-10-24(34)11-7-21/h4-11,16-18,28H,12-15,19H2,1-3H3InChIKey
BXNGHXAUSWZWPD-UHFFFAOYSA-NSynonyms
6((4(bis(4fluorophenyl)methyl)piperazin1yl)methyl)8methoxy44dimethyl4Hpyrrolo(321ij)quinoline12dione
CC1(C=C(C2=CC(=CC3=C2N1C(=O)C3=O)OC)CN4CCN(CC4)C(C5=CC=C(C=C5)F)C6=CC=C(C=C6)F)C
InChI=1SC32H31F2N3O3c132(2)1822(261625(403)172729(26)37(32)31(39)30(27)38)1935121436(151335)28(204823(33)9520)2161024(34)11721h411161828H121519H213H3
MFCD30713347
ZINC000334160358
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