2-{[5-(3,4-dimethylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
Chemical Structure Depiction of
2-{[5-(3,4-dimethylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
2-{[5-(3,4-dimethylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
Compound characteristics
Compound ID: | D489-0612 |
Compound Name: | 2-{[5-(3,4-dimethylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide |
Molecular Weight: | 421.54 |
Molecular Formula: | C21 H19 N5 O S2 |
Smiles: | Cc1ccc(cc1C)c1nnc(n1c1ccccc1)SCC(Nc1nccs1)=O |
Stereo: | ACHIRAL |
logP: | 4.816 |
logD: | 4.8156 |
logSw: | -4.5408 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.34 |
InChI Key: | QOUDVQRGAXOWTD-UHFFFAOYSA-N |