4-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-(3-fluorophenyl)butanamide
Chemical Structure Depiction of
4-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-(3-fluorophenyl)butanamide
4-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-(3-fluorophenyl)butanamide
Compound characteristics
| Compound ID: | F848-0379 |
| Compound Name: | 4-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-(3-fluorophenyl)butanamide |
| Molecular Weight: | 405.45 |
| Molecular Formula: | C18 H20 F N5 O3 S |
| Smiles: | CN(C)S(c1ccc2c(c1)nnn2CCCC(Nc1cccc(c1)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6159 |
| logD: | 1.6152 |
| logSw: | -2.6217 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.456 |
| InChI Key: | BQVILRAVRGDRNN-UHFFFAOYSA-N |