N-[(4-chlorophenyl)methyl]-2-ethyl-7-oxoazepane-2-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-ethyl-7-oxoazepane-2-carboxamide
N-[(4-chlorophenyl)methyl]-2-ethyl-7-oxoazepane-2-carboxamide
Compound characteristics
| Compound ID: | S515-0328 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-ethyl-7-oxoazepane-2-carboxamide |
| Molecular Weight: | 308.81 |
| Molecular Formula: | C16 H21 Cl N2 O2 |
| Smiles: | CCC1(CCCCC(N1)=O)C(NCc1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3567 |
| logD: | 2.3567 |
| logSw: | -3.1795 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.026 |
| InChI Key: | YSKTUKNNXAOMDA-INIZCTEOSA-N |