2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,6-dichlorophenyl)acetamide
Chemical Structure Depiction of
2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,6-dichlorophenyl)acetamide
2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,6-dichlorophenyl)acetamide
Compound characteristics
| Compound ID: | Y508-7736 |
| Compound Name: | 2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,6-dichlorophenyl)acetamide |
| Molecular Weight: | 483.8 |
| Molecular Formula: | C20 H17 Cl3 N4 O2 S |
| Smiles: | C=CCn1c(COc2ccc(cc2)[Cl])nnc1SCC(Nc1c(cccc1[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1827 |
| logD: | 5.1726 |
| logSw: | -5.6962 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.448 |
| InChI Key: | PMJOMALCTAXMFB-UHFFFAOYSA-N |