3-[5-(diethylsulfamoyl)-1H-benzotriazol-1-yl]-N-(4-fluorophenyl)propanamide
Chemical Structure Depiction of
3-[5-(diethylsulfamoyl)-1H-benzotriazol-1-yl]-N-(4-fluorophenyl)propanamide
3-[5-(diethylsulfamoyl)-1H-benzotriazol-1-yl]-N-(4-fluorophenyl)propanamide
Compound characteristics
Compound ID: | F514-0591 |
Compound Name: | 3-[5-(diethylsulfamoyl)-1H-benzotriazol-1-yl]-N-(4-fluorophenyl)propanamide |
Molecular Weight: | 419.48 |
Molecular Formula: | C19 H22 F N5 O3 S |
Smiles: | CCN(CC)S(c1ccc2c(c1)nnn2CCC(Nc1ccc(cc1)F)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.298 |
logD: | 2.2977 |
logSw: | -3.0561 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.889 |
InChI Key: | GQCYCPXZVPSULC-UHFFFAOYSA-N |