N-[2-(azepan-1-yl)ethyl]-4-chloro-3-[(3,4-dichlorophenyl)carbamamido]benzamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-4-chloro-3-[(3,4-dichlorophenyl)carbamamido]benzamide
N-[2-(azepan-1-yl)ethyl]-4-chloro-3-[(3,4-dichlorophenyl)carbamamido]benzamide
Compound characteristics
| Compound ID: | K786-5170 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-4-chloro-3-[(3,4-dichlorophenyl)carbamamido]benzamide |
| Molecular Weight: | 483.82 |
| Molecular Formula: | C22 H25 Cl3 N4 O2 |
| Smiles: | C1CCCN(CC1)CCNC(c1ccc(c(c1)NC(Nc1ccc(c(c1)[Cl])[Cl])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.8013 |
| logD: | 4.8246 |
| logSw: | -6.1286 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 60.412 |
| InChI Key: | WXLNCPDIXKCGPG-UHFFFAOYSA-N |