3-[5-(diethylsulfamoyl)-1H-benzotriazol-1-yl]-N-(3,4-dimethylphenyl)propanamide
Chemical Structure Depiction of
3-[5-(diethylsulfamoyl)-1H-benzotriazol-1-yl]-N-(3,4-dimethylphenyl)propanamide
3-[5-(diethylsulfamoyl)-1H-benzotriazol-1-yl]-N-(3,4-dimethylphenyl)propanamide
Compound characteristics
| Compound ID: | F514-0623 |
| Compound Name: | 3-[5-(diethylsulfamoyl)-1H-benzotriazol-1-yl]-N-(3,4-dimethylphenyl)propanamide |
| Molecular Weight: | 429.54 |
| Molecular Formula: | C21 H27 N5 O3 S |
| Smiles: | CCN(CC)S(c1ccc2c(c1)nnn2CCC(Nc1ccc(C)c(C)c1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2564 |
| logD: | 3.2564 |
| logSw: | -3.4599 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.889 |
| InChI Key: | WSEBYHBWIXFEGM-UHFFFAOYSA-N |