Vitas-M small molecule compound

1-[4-(5-fluoro-2-methoxybenzyl)piperazin-1-yl]-3-propylpyrido[1,2-a]benzimidazole-4-carbonitrile

Catalog ID
STK110317
SMILES CCCc1cc(N2CCN(CC2)Cc2cc(F)ccc2OC)n2c(c1C#N)nc1c2cccc1

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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 C27H28FN5O MW 457.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28FN5O/c1-3-6-19-16-26(33-24-8-5-4-7-23(24)30-27(33)22(19)17-29)32-13-11-31(12-14-32)18-20-15-21(28)9-10-25(20)34-2/h4-5,7-10,15-16H,3,6,11-14,18H2,1-2H3
InChIKey
GIHVFYFYEBATHL-UHFFFAOYSA-N
Synonyms
442572-49-8
1(4((5FLUORO2METHOXYPHENYL)METHYL)PIPERAZIN1YL)3PROPYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
1(4(5FLUORO2METHOXYBENZYL)1PIPERAZINYL)3PROPYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
1(4(5fluoro2methoxybenzyl)piperazin1yl)3propylbenzo(45)imidazo(12a)pyridine4carbonitrile
1(4(5FLUORO2METHOXYBENZYL)PIPERAZIN1YL)3PROPYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
4(4((5FLUORO2METHOXYPHENYL)METHYL)PIPERAZINYL)2PROPYL5HYDROPYRIDINO(12A)BENZIMIDAZOLECARBONITRILE
442572498
CCCC1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CCN(CC4)CC5=C(C=CC(=C5)F)OC)C#N
InChI=1SC27H28FN5Oc136191626(3324854723(24)3027(33)22(19)1729)32131131(121432)18201521(28)91025(20)342h457101516H36111418H212H3
MFCD03268787
ZINC000019809133
ZINC19809133

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Available files

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