N-(5-chloro-2-methylphenyl)-2-{[5-(5-methylthiophen-3-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methylphenyl)-2-{[5-(5-methylthiophen-3-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(5-chloro-2-methylphenyl)-2-{[5-(5-methylthiophen-3-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y205-5284 |
| Compound Name: | N-(5-chloro-2-methylphenyl)-2-{[5-(5-methylthiophen-3-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 420.98 |
| Molecular Formula: | C19 H21 Cl N4 O S2 |
| Smiles: | CC(C)n1c(c2cc(C)sc2)nnc1SCC(Nc1cc(ccc1C)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.596 |
| logD: | 4.5956 |
| logSw: | -4.6437 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.786 |
| InChI Key: | ZACCTCREAMVPIM-UHFFFAOYSA-N |