N-(5-{[(4-chlorophenyl)methyl](methyl)sulfamoyl}-1,3,4-thiadiazol-2-yl)-3-nitrobenzamide
Chemical Structure Depiction of
N-(5-{[(4-chlorophenyl)methyl](methyl)sulfamoyl}-1,3,4-thiadiazol-2-yl)-3-nitrobenzamide
N-(5-{[(4-chlorophenyl)methyl](methyl)sulfamoyl}-1,3,4-thiadiazol-2-yl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | E880-0716 |
| Compound Name: | N-(5-{[(4-chlorophenyl)methyl](methyl)sulfamoyl}-1,3,4-thiadiazol-2-yl)-3-nitrobenzamide |
| Molecular Weight: | 467.91 |
| Molecular Formula: | C17 H14 Cl N5 O5 S2 |
| Smiles: | CN(Cc1ccc(cc1)[Cl])S(c1nnc(NC(c2cccc(c2)[N+]([O-])=O)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9887 |
| logD: | 1.2474 |
| logSw: | -4.4984 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 112.595 |
| InChI Key: | PHIUVIDQNUAGGF-UHFFFAOYSA-N |