N-(4-acetylphenyl)-2-{[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-acetylphenyl)-2-{[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(4-acetylphenyl)-2-{[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | G731-0333 |
Compound Name: | N-(4-acetylphenyl)-2-{[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
Molecular Weight: | 370.4 |
Molecular Formula: | C18 H15 F N4 O2 S |
Smiles: | CC(c1ccc(cc1)NC(CSc1nnc(c2ccc(cc2)F)[nH]1)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.4319 |
logD: | 1.2402 |
logSw: | -2.7507 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 69.45 |
InChI Key: | SMKPQUGYJUCFKY-UHFFFAOYSA-N |