N-(3,4-dichlorophenyl)-2-{[4-(4-fluorophenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3,4-dichlorophenyl)-2-{[4-(4-fluorophenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(3,4-dichlorophenyl)-2-{[4-(4-fluorophenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y600-1508 |
| Compound Name: | N-(3,4-dichlorophenyl)-2-{[4-(4-fluorophenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 479.38 |
| Molecular Formula: | C20 H13 Cl2 F N4 O S2 |
| Smiles: | C(C(Nc1ccc(c(c1)[Cl])[Cl])=O)Sc1nnc(c2cccs2)n1c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 6.0113 |
| logD: | 6.0047 |
| logSw: | -6.3417 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.88 |
| InChI Key: | MHLAHYDTGFDKKM-UHFFFAOYSA-N |