3-(4-methylphenyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
Chemical Structure Depiction of
3-(4-methylphenyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
3-(4-methylphenyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
Compound characteristics
| Compound ID: | E475-1296 |
| Compound Name: | 3-(4-methylphenyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide |
| Molecular Weight: | 471.65 |
| Molecular Formula: | C29 H37 N5 O |
| Smiles: | Cc1ccc(cc1)c1nc(C(NCCCN2CCN(CC2)c2ccccc2)=O)c2CCCCCn12 |
| Stereo: | ACHIRAL |
| logP: | 4.9203 |
| logD: | 4.3765 |
| logSw: | -4.3479 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.577 |
| InChI Key: | GRVCMIOYPUOCPU-UHFFFAOYSA-N |