N-(4-acetylphenyl)-2-{[5-(4-methyl-1H-imidazol-5-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-acetylphenyl)-2-{[5-(4-methyl-1H-imidazol-5-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(4-acetylphenyl)-2-{[5-(4-methyl-1H-imidazol-5-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8017-3862 |
| Compound Name: | N-(4-acetylphenyl)-2-{[5-(4-methyl-1H-imidazol-5-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 432.5 |
| Molecular Formula: | C22 H20 N6 O2 S |
| Smiles: | CC(c1ccc(cc1)NC(CSc1nnc(c2c(C)nc[nH]2)n1c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3059 |
| logD: | 2.3045 |
| logSw: | -2.6702 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.864 |
| InChI Key: | LLUFKFGPGBCBNU-UHFFFAOYSA-N |