2-{[4-methyl-5-(5-methylthiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1-phenylethyl)acetamide
Chemical Structure Depiction of
2-{[4-methyl-5-(5-methylthiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1-phenylethyl)acetamide
2-{[4-methyl-5-(5-methylthiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1-phenylethyl)acetamide
Compound characteristics
Compound ID: | Y205-4963 |
Compound Name: | 2-{[4-methyl-5-(5-methylthiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1-phenylethyl)acetamide |
Molecular Weight: | 372.51 |
Molecular Formula: | C18 H20 N4 O S2 |
Smiles: | CC(c1ccccc1)NC(CSc1nnc(c2cc(C)sc2)n1C)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.1709 |
logD: | 3.1708 |
logSw: | -3.4213 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.704 |
InChI Key: | QSWOJFQRUHTJKL-ZDUSSCGKSA-N |