2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-dimethylphenyl)acetamide
2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-dimethylphenyl)acetamide
Compound characteristics
Compound ID: | F019-0030 |
Compound Name: | 2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-dimethylphenyl)acetamide |
Molecular Weight: | 479 |
Molecular Formula: | C25 H23 Cl N4 O2 S |
Smiles: | Cc1ccc(cc1C)NC(CSc1nnc(c2ccc(cc2)OC)n1c1ccc(cc1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 6.3521 |
logD: | 6.3521 |
logSw: | -6.3386 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.406 |
InChI Key: | CYACDZVWGRTGTH-UHFFFAOYSA-N |