2-{3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
Chemical Structure Depiction of
2-{3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
2-{3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
Compound characteristics
| Compound ID: | Y042-9129 |
| Compound Name: | 2-{3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile |
| Molecular Weight: | 469.54 |
| Molecular Formula: | C27 H27 N5 O3 |
| Smiles: | CC1=C(CCC(N2CCN(CC2)c2ccc(cc2)OC)=O)C(N2C(=C1C#N)Nc1ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9628 |
| logD: | 2.962 |
| logSw: | -3.4138 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.484 |
| InChI Key: | LMBVDOQRIQXJNJ-UHFFFAOYSA-N |