ethyl 4-(azepan-1-yl)-3-[(3,4-dichlorophenyl)carbamamido]benzoate
Chemical Structure Depiction of
ethyl 4-(azepan-1-yl)-3-[(3,4-dichlorophenyl)carbamamido]benzoate
ethyl 4-(azepan-1-yl)-3-[(3,4-dichlorophenyl)carbamamido]benzoate
Compound characteristics
| Compound ID: | K784-6163 |
| Compound Name: | ethyl 4-(azepan-1-yl)-3-[(3,4-dichlorophenyl)carbamamido]benzoate |
| Molecular Weight: | 450.36 |
| Molecular Formula: | C22 H25 Cl2 N3 O3 |
| Smiles: | CCOC(c1ccc(c(c1)NC(Nc1ccc(c(c1)[Cl])[Cl])=O)N1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.3011 |
| logD: | 7.2944 |
| logSw: | -6.5621 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.08 |
| InChI Key: | MMUNZMVRQHBSIZ-UHFFFAOYSA-N |