2-chloro-N-(6-{4-[(4-chlorophenoxy)acetyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
Chemical Structure Depiction of
2-chloro-N-(6-{4-[(4-chlorophenoxy)acetyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
2-chloro-N-(6-{4-[(4-chlorophenoxy)acetyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
Compound characteristics
| Compound ID: | V017-7676 |
| Compound Name: | 2-chloro-N-(6-{4-[(4-chlorophenoxy)acetyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide |
| Molecular Weight: | 499.4 |
| Molecular Formula: | C25 H24 Cl2 N4 O3 |
| Smiles: | C1CN(CCN(C1)c1ccc(cn1)NC(c1ccccc1[Cl])=O)C(COc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7702 |
| logD: | 4.7676 |
| logSw: | -4.8618 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.142 |
| InChI Key: | XEBYQNIXTWLXDV-UHFFFAOYSA-N |