3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-[3-(methylsulfanyl)phenyl]propanamide
Chemical Structure Depiction of
3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-[3-(methylsulfanyl)phenyl]propanamide
3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-[3-(methylsulfanyl)phenyl]propanamide
Compound characteristics
| Compound ID: | F514-0498 |
| Compound Name: | 3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-[3-(methylsulfanyl)phenyl]propanamide |
| Molecular Weight: | 419.52 |
| Molecular Formula: | C18 H21 N5 O3 S2 |
| Smiles: | CN(C)S(c1ccc2c(c1)nnn2CCC(Nc1cccc(c1)SC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1434 |
| logD: | 2.1434 |
| logSw: | -3.0123 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.456 |
| InChI Key: | ZWWVBKKPAKLZOD-UHFFFAOYSA-N |