3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-[(4-methylphenyl)methyl]propanamide
Chemical Structure Depiction of
3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-[(4-methylphenyl)methyl]propanamide
3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-[(4-methylphenyl)methyl]propanamide
Compound characteristics
| Compound ID: | F514-0455 |
| Compound Name: | 3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-[(4-methylphenyl)methyl]propanamide |
| Molecular Weight: | 401.49 |
| Molecular Formula: | C19 H23 N5 O3 S |
| Smiles: | Cc1ccc(CNC(CCn2c3ccc(cc3nn2)S(N(C)C)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.8061 |
| logD: | 1.8061 |
| logSw: | -2.6866 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.778 |
| InChI Key: | XFFVYFMBOWUWAJ-UHFFFAOYSA-N |