2-{[4-ethyl-5-(1-methyl-3-phenyl-1H-pyrazol-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethylphenyl)acetamide
Chemical Structure Depiction of
2-{[4-ethyl-5-(1-methyl-3-phenyl-1H-pyrazol-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethylphenyl)acetamide
2-{[4-ethyl-5-(1-methyl-3-phenyl-1H-pyrazol-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | L849-1480 |
| Compound Name: | 2-{[4-ethyl-5-(1-methyl-3-phenyl-1H-pyrazol-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethylphenyl)acetamide |
| Molecular Weight: | 446.57 |
| Molecular Formula: | C24 H26 N6 O S |
| Smiles: | CCc1ccc(cc1)NC(CSc1nnc(c2cn(C)nc2c2ccccc2)n1CC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2778 |
| logD: | 4.2777 |
| logSw: | -4.0938 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.199 |
| InChI Key: | DWSVLJQVMKOJGL-UHFFFAOYSA-N |