N-[(4-methylphenyl)methyl]-2-{[4-methyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-{[4-methyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-[(4-methylphenyl)methyl]-2-{[4-methyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | L850-1730 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-{[4-methyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 420.49 |
| Molecular Formula: | C21 H20 N6 O2 S |
| Smiles: | Cc1ccc(CNC(CSc2nnc(c3nc(c4ccccc4)no3)n2C)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4882 |
| logD: | 3.4882 |
| logSw: | -3.6693 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.2 |
| InChI Key: | HIKZYYIICLANKY-UHFFFAOYSA-N |