7-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-7-[(pyridin-3-yl)methyl]azepan-2-one
Chemical Structure Depiction of
7-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-7-[(pyridin-3-yl)methyl]azepan-2-one
7-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-7-[(pyridin-3-yl)methyl]azepan-2-one
Compound characteristics
| Compound ID: | S515-0803 |
| Compound Name: | 7-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-7-[(pyridin-3-yl)methyl]azepan-2-one |
| Molecular Weight: | 420.55 |
| Molecular Formula: | C25 H32 N4 O2 |
| Smiles: | Cc1ccc(CN2CCN(CC2)C(C2(CCCCC(N2)=O)Cc2cccnc2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8016 |
| logD: | 1.6801 |
| logSw: | -1.6269 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.048 |
| InChI Key: | IODRBPJZMDLWMK-RUZDIDTESA-N |