Vitas-M small molecule compound
methyl 3-{4-cyano-1-[4-(3,4-dichlorobenzyl)piperazin-1-yl]-3-methylpyrido[1,2-a]benzimidazol-2-yl}propanoate
Catalog ID
STL023570
SMILES COC(=O)CCc1c(C)c(C#N)c2n(c1N1CCN(CC1)Cc1ccc(c(c1)Cl)Cl)c1ccccc1n2
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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 C28H27Cl2N5O2 MW 536.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27Cl2N5O2/c1-18-20(8-10-26(36)37-2)28(35-25-6-4-3-5-24(25)32-27(35)21(18)16-31)34-13-11-33(12-14-34)17-19-7-9-22(29)23(30)15-19/h3-7,9,15H,8,10-14,17H2,1-2H3InChIKey
CXDXRPHWNFNHJJ-UHFFFAOYSA-NSynonyms
845664-30-4845664304
CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC(=O)OC)N4CCN(CC4)CC5=CC(=C(C=C5)Cl)Cl)C#N
InChI=1SC28H27Cl2N5O2c11820(81026(36)372)28(3525643524(25)3227(35)21(18)1631)34131133(121434)17197922(29)23(30)1519h37915H8101417H212H3
METHYL3(1(4((34DICHLOROPHENYL)METHYL)PIPERAZINYL)4CYANO3METHYL10HYDROPYRIDINO(12A)BENZIMIDAZOL2YL)PROPANOATE
METHYL3(4CYANO1(4((34DICHLOROPHENYL)METHYL)PIPERAZIN1YL)3METHYLPYRIDO(12A)BENZIMIDAZOL2YL)PROPANOATE
methyl3(4cyano1(4(34dichlorobenzyl)piperazin1yl)3methylbenzo(45)imidazo(12a)pyridin2yl)propanoate
methyl3(4cyano1(4(34dichlorobenzyl)piperazin1yl)3methylpyrido(12a)benzimidazol2yl)propanoate
MFCD04168759
ZINC000050860559
ZINC50860559
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.