1-(2,4-dichlorophenyl)-2-{[4-methyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(2,4-dichlorophenyl)-2-{[4-methyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
1-(2,4-dichlorophenyl)-2-{[4-methyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | G786-1514 |
| Compound Name: | 1-(2,4-dichlorophenyl)-2-{[4-methyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 384.3 |
| Molecular Formula: | C15 H11 Cl2 N3 O S2 |
| Smiles: | Cn1c(c2cccs2)nnc1SCC(c1ccc(cc1[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4134 |
| logD: | 4.4133 |
| logSw: | -4.6692 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.316 |
| InChI Key: | ZHLYOERVIOQXNA-UHFFFAOYSA-N |