4-(azepane-1-sulfonyl)-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}benzamide
Chemical Structure Depiction of
4-(azepane-1-sulfonyl)-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}benzamide
4-(azepane-1-sulfonyl)-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}benzamide
Compound characteristics
| Compound ID: | 3931-0081 |
| Compound Name: | 4-(azepane-1-sulfonyl)-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}benzamide |
| Molecular Weight: | 543.66 |
| Molecular Formula: | C25 H29 N5 O5 S2 |
| Smiles: | Cc1cc(C)nc(NS(c2ccc(cc2)NC(c2ccc(cc2)S(N2CCCCCC2)(=O)=O)=O)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.1317 |
| logD: | 2.6495 |
| logSw: | -3.4893 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 115.34 |
| InChI Key: | WJVNRHMDRRVCFF-UHFFFAOYSA-N |