2-{[4-benzyl-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-{[4-benzyl-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[(4-methylphenyl)methyl]acetamide
2-{[4-benzyl-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | 8018-5585 |
| Compound Name: | 2-{[4-benzyl-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 456.61 |
| Molecular Formula: | C27 H28 N4 O S |
| Smiles: | Cc1ccc(CNC(CSc2nnc(CCc3ccccc3)n2Cc2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.245 |
| logD: | 5.245 |
| logSw: | -5.1028 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.417 |
| InChI Key: | MZXCRDPAYPRKLM-UHFFFAOYSA-N |