4-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-[(4-ethoxyphenyl)methyl]butanamide
Chemical Structure Depiction of
4-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-[(4-ethoxyphenyl)methyl]butanamide
4-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-[(4-ethoxyphenyl)methyl]butanamide
Compound characteristics
| Compound ID: | G373-1650 |
| Compound Name: | 4-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]-N-[(4-ethoxyphenyl)methyl]butanamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C21 H27 N5 O4 S |
| Smiles: | CCOc1ccc(CNC(CCCn2c3ccc(cc3nn2)S(N(C)C)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.5317 |
| logD: | 1.5317 |
| logSw: | -2.6036 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.902 |
| InChI Key: | IIIQWRGDCYAGMC-UHFFFAOYSA-N |