11-[4-(adamantan-1-yl)piperazin-1-yl]-2,3-dihydro-1H-cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrile
Chemical Structure Depiction of
11-[4-(adamantan-1-yl)piperazin-1-yl]-2,3-dihydro-1H-cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrile
11-[4-(adamantan-1-yl)piperazin-1-yl]-2,3-dihydro-1H-cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrile
Compound characteristics
| Compound ID: | C063-0008 |
| Compound Name: | 11-[4-(adamantan-1-yl)piperazin-1-yl]-2,3-dihydro-1H-cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrile |
| Molecular Weight: | 451.61 |
| Molecular Formula: | C29 H33 N5 |
| Smiles: | C1CC2=C(C#N)c3nc4ccccc4n3C(=C2C1)N1CCN(CC1)C12CC3CC(CC(C3)C2)C1 |
| Stereo: | ACHIRAL |
| logP: | 5.9091 |
| logD: | 5.2094 |
| logSw: | -6.0641 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 35.433 |
| InChI Key: | NGPUKWYSLVWPMW-UHFFFAOYSA-N |