ethyl {[5-(4-chloroanilino)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[5-(4-chloroanilino)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
ethyl {[5-(4-chloroanilino)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | 3342-1858 |
| Compound Name: | ethyl {[5-(4-chloroanilino)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate |
| Molecular Weight: | 423.32 |
| Molecular Formula: | C18 H16 Cl2 N4 O2 S |
| Smiles: | CCOC(CSc1nnc(Nc2ccc(cc2)[Cl])n1c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.156 |
| logD: | 5.156 |
| logSw: | -5.4529 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.234 |
| InChI Key: | YMJAZOLGRFELGC-UHFFFAOYSA-N |