N-(2H-1,3-benzodioxol-5-yl)-3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]propanamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]propanamide
N-(2H-1,3-benzodioxol-5-yl)-3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]propanamide
Compound characteristics
| Compound ID: | F514-0502 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]propanamide |
| Molecular Weight: | 417.44 |
| Molecular Formula: | C18 H19 N5 O5 S |
| Smiles: | CN(C)S(c1ccc2c(c1)nnn2CCC(Nc1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5156 |
| logD: | 1.5155 |
| logSw: | -2.6275 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.571 |
| InChI Key: | LBKILUUQHODREW-UHFFFAOYSA-N |