N-(5-chloro-2-methylphenyl)-4-[5-(diethylsulfamoyl)-1H-benzotriazol-1-yl]butanamide
Chemical Structure Depiction of
N-(5-chloro-2-methylphenyl)-4-[5-(diethylsulfamoyl)-1H-benzotriazol-1-yl]butanamide
N-(5-chloro-2-methylphenyl)-4-[5-(diethylsulfamoyl)-1H-benzotriazol-1-yl]butanamide
Compound characteristics
| Compound ID: | F848-0495 |
| Compound Name: | N-(5-chloro-2-methylphenyl)-4-[5-(diethylsulfamoyl)-1H-benzotriazol-1-yl]butanamide |
| Molecular Weight: | 463.99 |
| Molecular Formula: | C21 H26 Cl N5 O3 S |
| Smiles: | CCN(CC)S(c1ccc2c(c1)nnn2CCCC(Nc1cc(ccc1C)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5062 |
| logD: | 2.5049 |
| logSw: | -3.4933 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.191 |
| InChI Key: | BSMXXAIAPLPJQS-UHFFFAOYSA-N |