2-[3-(azepane-1-sulfonyl)benzamido]-N-(4-chlorophenyl)benzamide
Chemical Structure Depiction of
2-[3-(azepane-1-sulfonyl)benzamido]-N-(4-chlorophenyl)benzamide
2-[3-(azepane-1-sulfonyl)benzamido]-N-(4-chlorophenyl)benzamide
Compound characteristics
Compound ID: | K838-0078 |
Compound Name: | 2-[3-(azepane-1-sulfonyl)benzamido]-N-(4-chlorophenyl)benzamide |
Molecular Weight: | 512.03 |
Molecular Formula: | C26 H26 Cl N3 O4 S |
Smiles: | C1CCCN(CC1)S(c1cccc(c1)C(Nc1ccccc1C(Nc1ccc(cc1)[Cl])=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.0489 |
logD: | 5.0422 |
logSw: | -5.1049 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 77.765 |
InChI Key: | NJUOAUQRDPFWQF-UHFFFAOYSA-N |