N-(2-chlorophenyl)-2-{[4-ethyl-5-(4-ethyl-5-methylthiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-chlorophenyl)-2-{[4-ethyl-5-(4-ethyl-5-methylthiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(2-chlorophenyl)-2-{[4-ethyl-5-(4-ethyl-5-methylthiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y205-6482 |
| Compound Name: | N-(2-chlorophenyl)-2-{[4-ethyl-5-(4-ethyl-5-methylthiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 420.98 |
| Molecular Formula: | C19 H21 Cl N4 O S2 |
| Smiles: | CCc1c(csc1C)c1nnc(n1CC)SCC(Nc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.684 |
| logD: | 4.6838 |
| logSw: | -4.7609 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.435 |
| InChI Key: | DALDQERMTQPBDM-UHFFFAOYSA-N |