methyl 3-(4-cyano-1-{4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl}-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate
Chemical Structure Depiction of
methyl 3-(4-cyano-1-{4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl}-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate
methyl 3-(4-cyano-1-{4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl}-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate
Compound characteristics
| Compound ID: | IB05-2755 |
| Compound Name: | methyl 3-(4-cyano-1-{4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl}-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate |
| Molecular Weight: | 536.46 |
| Molecular Formula: | C28 H27 Cl2 N5 O2 |
| Smiles: | Cc1c(CCC(=O)OC)c(N2CCN(CC2)Cc2ccc(c(c2)[Cl])[Cl])n2c3ccccc3nc2c1C#N |
| Stereo: | ACHIRAL |
| logP: | 6.33 |
| logD: | 5.39 |
| logSw: | -7.46 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 89.25 |
| InChI Key: | CXDXRPHWNFNHJJ-UHFFFAOYSA-N |