Vitas-M small molecule compound

1-[4-(3,4-dichlorobenzyl)piperazin-1-yl]-3-methyl-2-(3-methylbutyl)pyrido[1,2-a]benzimidazole-4-carbonitrile

Catalog ID
STK107617
SMILES N#Cc1c(C)c(CCC(C)C)c(n2c1nc1c2cccc1)N1CCN(CC1)Cc1ccc(c(c1)Cl)Cl

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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 C29H31Cl2N5 MW 520.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31Cl2N5/c1-19(2)8-10-22-20(3)23(17-32)28-33-26-6-4-5-7-27(26)36(28)29(22)35-14-12-34(13-15-35)18-21-9-11-24(30)25(31)16-21/h4-7,9,11,16,19H,8,10,12-15,18H2,1-3H3
InChIKey
UKJKGAXQKIEAEH-UHFFFAOYSA-N
Synonyms
383903-01-3
1(4((34DICHLOROPHENYL)METHYL)PIPERAZIN1YL)3METHYL2(3METHYLBUTYL)PYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
1(4(34dichlorobenzyl)piperazin1yl)2isopentyl3methylbenzo(45)imidazo(12a)pyridine4carbonitrile
1(4(34DICHLOROBENZYL)PIPERAZIN1YL)3METHYL2(3METHYLBUTYL)PYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
383903013
4(4((34DICHLOROPHENYL)METHYL)PIPERAZINYL)2METHYL3(3METHYLBUTYL)5HYDROPYRIDINO(12A)BENZIMIDAZOLECARBONITRILE
CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC(C)C)N4CCN(CC4)CC5=CC(=C(C=C5)Cl)Cl)C#N
InChI=1SC29H31Cl2N5c119(2)8102220(3)23(1732)283326645727(26)36(28)29(22)35141234(131535)182191124(30)25(31)1621h479111619H810121518H213H3
MFCD03283950
ZINC000019808372
ZINC19808372

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Available files

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