1-benzyl-7-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}azepan-2-one
Chemical Structure Depiction of
1-benzyl-7-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}azepan-2-one
1-benzyl-7-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}azepan-2-one
Compound characteristics
| Compound ID: | S513-0657 |
| Compound Name: | 1-benzyl-7-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}azepan-2-one |
| Molecular Weight: | 419.57 |
| Molecular Formula: | C26 H33 N3 O2 |
| Smiles: | Cc1ccc(CN2CCN(CC2)C(C2CCCCC(N2Cc2ccccc2)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1682 |
| logD: | 3.0886 |
| logSw: | -3.0223 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.168 |
| InChI Key: | CCYAPCLIGVUTKS-DEOSSOPVSA-N |