Vitas-M small molecule compound
methyl 4-(3-{4-[bis(4-fluorophenyl)methyl]piperazin-1-yl}-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzoate
Catalog ID
STK663087
SMILES COC(=O)c1ccc(cc1)N1C(=O)C=C(C1=O)N1CCN(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 C29H25F2N3O4 MW 517.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25F2N3O4/c1-38-29(37)21-6-12-24(13-7-21)34-26(35)18-25(28(34)36)32-14-16-33(17-15-32)27(19-2-8-22(30)9-3-19)20-4-10-23(31)11-5-20/h2-13,18,27H,14-17H2,1H3InChIKey
QCSZWCSITSXXCW-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=C(C=C1)N2C(=O)C=C(C2=O)N3CCN(CC3)C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F
InChI=1SC29H25F2N3O4c13829(37)2161224(13721)3426(35)1825(28(34)36)32141633(171532)27(192822(30)9319)2041023(31)11520h2131827H1417H21H3
METHYL4(3(4(BIS(4FLUOROPHENYL)METHYL)PIPERAZIN1YL)25DIOXO25DIHYDRO1HPYRROL1YL)BENZOATE
METHYL4(3(4(BIS(4FLUOROPHENYL)METHYL)PIPERAZIN1YL)25DIOXOPYRROL1YL)BENZOATE
MFCD04138773
ZINC000015319471
ZINC15319471
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