4-acetamido-N-(2-{5-[(propan-2-yl)sulfamoyl]-1H-benzotriazol-1-yl}ethyl)benzamide
Chemical Structure Depiction of
4-acetamido-N-(2-{5-[(propan-2-yl)sulfamoyl]-1H-benzotriazol-1-yl}ethyl)benzamide
4-acetamido-N-(2-{5-[(propan-2-yl)sulfamoyl]-1H-benzotriazol-1-yl}ethyl)benzamide
Compound characteristics
| Compound ID: | M486-0978 |
| Compound Name: | 4-acetamido-N-(2-{5-[(propan-2-yl)sulfamoyl]-1H-benzotriazol-1-yl}ethyl)benzamide |
| Molecular Weight: | 444.51 |
| Molecular Formula: | C20 H24 N6 O4 S |
| Smiles: | CC(C)NS(c1ccc2c(c1)nnn2CCNC(c1ccc(cc1)NC(C)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9697 |
| logD: | 0.9695 |
| logSw: | -2.3801 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 114.649 |
| InChI Key: | NDMSLOAXMMWOMZ-UHFFFAOYSA-N |