2-{3-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-5-yl}-N-[(thiophen-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{3-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-5-yl}-N-[(thiophen-2-yl)methyl]acetamide
2-{3-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-5-yl}-N-[(thiophen-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | P496-1687 |
| Compound Name: | 2-{3-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-5-yl}-N-[(thiophen-2-yl)methyl]acetamide |
| Molecular Weight: | 326.42 |
| Molecular Formula: | C17 H18 N4 O S |
| Smiles: | Cc1cccc(Cc2nc(CC(NCc3cccs3)=O)[nH]n2)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.2321 |
| logD: | 3.2295 |
| logSw: | -3.2627 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.223 |
| InChI Key: | AGVGTLQKKHBNJK-UHFFFAOYSA-N |