Vitas-M small molecule compound

2-({4-[bis(4-fluorophenyl)methyl]piperazin-1-yl}methyl)-5-methoxy-1-methyl-1H-benzimidazole

Catalog ID
STK498381
SMILES COc1ccc2c(c1)nc(n2C)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 C27H28F2N4O MW 462.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28F2N4O/c1-31-25-12-11-23(34-2)17-24(25)30-26(31)18-32-13-15-33(16-14-32)27(19-3-7-21(28)8-4-19)20-5-9-22(29)10-6-20/h3-12,17,27H,13-16,18H2,1-2H3
InChIKey
JORXSQIBVMMADQ-UHFFFAOYSA-N
Synonyms

2((4(bis(4fluorophenyl)methyl)piperazin1yl)methyl)5methoxy1methyl1Hbenzimidazole
2((4(bis(4fluorophenyl)methyl)piperazin1yl)methyl)5methoxy1methylbenzimidazole
CN1C2=C(C=C(C=C2)OC)N=C1CN3CCN(CC3)C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F
InChI=1SC27H28F2N4Oc13125121123(342)1724(25)3026(31)1832131533(161432)27(193721(28)8419)205922(29)10620h3121727H131618H212H3
MFCD11855375
ZINC000021175585
ZINC21175585

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.