N-{[4-(3-chlorophenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-2-phenoxyacetamide
Chemical Structure Depiction of
N-{[4-(3-chlorophenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-2-phenoxyacetamide
N-{[4-(3-chlorophenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-2-phenoxyacetamide
Compound characteristics
| Compound ID: | 3330-2917 |
| Compound Name: | N-{[4-(3-chlorophenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-2-phenoxyacetamide |
| Molecular Weight: | 374.85 |
| Molecular Formula: | C17 H15 Cl N4 O2 S |
| Smiles: | C(C1=NNC(N1c1cccc(c1)[Cl])=S)NC(COc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1176 |
| logD: | 1.3854 |
| logSw: | -3.4886 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.8 |
| InChI Key: | NGFUCGZODZAPPI-UHFFFAOYSA-N |