5-(azepane-1-sulfonyl)-2-chloro-N-(3,4-dimethoxyphenyl)benzamide
Chemical Structure Depiction of
5-(azepane-1-sulfonyl)-2-chloro-N-(3,4-dimethoxyphenyl)benzamide
5-(azepane-1-sulfonyl)-2-chloro-N-(3,4-dimethoxyphenyl)benzamide
Compound characteristics
| Compound ID: | L586-0889 |
| Compound Name: | 5-(azepane-1-sulfonyl)-2-chloro-N-(3,4-dimethoxyphenyl)benzamide |
| Molecular Weight: | 452.96 |
| Molecular Formula: | C21 H25 Cl N2 O5 S |
| Smiles: | COc1ccc(cc1OC)NC(c1cc(ccc1[Cl])S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.926 |
| logD: | 3.8755 |
| logSw: | -4.4039 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.632 |
| InChI Key: | YHIRFCWRUSCVRJ-UHFFFAOYSA-N |