N-(4-acetylphenyl)-2-{[4-benzyl-5-(quinolin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-acetylphenyl)-2-{[4-benzyl-5-(quinolin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(4-acetylphenyl)-2-{[4-benzyl-5-(quinolin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8015-4565 |
| Compound Name: | N-(4-acetylphenyl)-2-{[4-benzyl-5-(quinolin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 493.59 |
| Molecular Formula: | C28 H23 N5 O2 S |
| Smiles: | CC(c1ccc(cc1)NC(CSc1nnc(c2ccc3ccccc3n2)n1Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7851 |
| logD: | 4.7849 |
| logSw: | -5.3274 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.276 |
| InChI Key: | SNOCRYGDZGZEDX-UHFFFAOYSA-N |