3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-[3-(trifluoromethyl)phenyl]propanamide
Chemical Structure Depiction of
3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-[3-(trifluoromethyl)phenyl]propanamide
3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-[3-(trifluoromethyl)phenyl]propanamide
Compound characteristics
| Compound ID: | F514-0413 |
| Compound Name: | 3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-[3-(trifluoromethyl)phenyl]propanamide |
| Molecular Weight: | 441.43 |
| Molecular Formula: | C18 H18 F3 N5 O3 S |
| Smiles: | CN(C)S(c1ccc2c(c1)nnn2CCC(Nc1cccc(c1)C(F)(F)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7257 |
| logD: | 2.7244 |
| logSw: | -3.41 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.456 |
| InChI Key: | HMLPHRIOMIVFHZ-UHFFFAOYSA-N |