5-(azepane-1-sulfonyl)-N-[(4-butoxyphenyl)methyl]-2-chlorobenzamide
Chemical Structure Depiction of
5-(azepane-1-sulfonyl)-N-[(4-butoxyphenyl)methyl]-2-chlorobenzamide
5-(azepane-1-sulfonyl)-N-[(4-butoxyphenyl)methyl]-2-chlorobenzamide
Compound characteristics
| Compound ID: | L586-1083 |
| Compound Name: | 5-(azepane-1-sulfonyl)-N-[(4-butoxyphenyl)methyl]-2-chlorobenzamide |
| Molecular Weight: | 479.04 |
| Molecular Formula: | C24 H31 Cl N2 O4 S |
| Smiles: | CCCCOc1ccc(CNC(c2cc(ccc2[Cl])S(N2CCCCCC2)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.787 |
| logD: | 5.787 |
| logSw: | -5.9008 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.112 |
| InChI Key: | MQYJSJAVMYKLAQ-UHFFFAOYSA-N |