4-(diethylsulfamoyl)-N-{[4-(3-methylphenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}benzamide
Chemical Structure Depiction of
4-(diethylsulfamoyl)-N-{[4-(3-methylphenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}benzamide
4-(diethylsulfamoyl)-N-{[4-(3-methylphenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}benzamide
Compound characteristics
| Compound ID: | 3330-2973 |
| Compound Name: | 4-(diethylsulfamoyl)-N-{[4-(3-methylphenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}benzamide |
| Molecular Weight: | 459.59 |
| Molecular Formula: | C21 H25 N5 O3 S2 |
| Smiles: | CCN(CC)S(c1ccc(cc1)C(NCC1=NNC(N1c1cccc(C)c1)=S)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0375 |
| logD: | 2.7029 |
| logSw: | -3.3844 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.61 |
| InChI Key: | DSITVDFVJUPLKO-UHFFFAOYSA-N |