ethyl {[4-(3,4-dichlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[4-(3,4-dichlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
ethyl {[4-(3,4-dichlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | V006-2337 |
| Compound Name: | ethyl {[4-(3,4-dichlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate |
| Molecular Weight: | 438.33 |
| Molecular Formula: | C19 H17 Cl2 N3 O3 S |
| Salt: | not_available |
| Smiles: | CCOC(CSc1nnc(c2ccc(cc2)OC)n1c1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2893 |
| logD: | 5.2893 |
| logSw: | -6.0346 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.687 |
| InChI Key: | YFMXRWOIGXCCKS-UHFFFAOYSA-N |