N-{4-(azepan-1-yl)-3-[(3-methylphenyl)carbamamido]phenyl}benzamide
Chemical Structure Depiction of
N-{4-(azepan-1-yl)-3-[(3-methylphenyl)carbamamido]phenyl}benzamide
N-{4-(azepan-1-yl)-3-[(3-methylphenyl)carbamamido]phenyl}benzamide
Compound characteristics
| Compound ID: | F694-1372 |
| Compound Name: | N-{4-(azepan-1-yl)-3-[(3-methylphenyl)carbamamido]phenyl}benzamide |
| Molecular Weight: | 442.56 |
| Molecular Formula: | C27 H30 N4 O2 |
| Smiles: | Cc1cccc(c1)NC(Nc1cc(ccc1N1CCCCCC1)NC(c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.309 |
| logD: | 6.05 |
| logSw: | -5.4806 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 58.417 |
| InChI Key: | BXTXUYNDNGNLAB-UHFFFAOYSA-N |