N-(4-methylphenyl)-2-({4-methyl-5-[(thiophen-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(4-methylphenyl)-2-({4-methyl-5-[(thiophen-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
N-(4-methylphenyl)-2-({4-methyl-5-[(thiophen-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | Y205-7016 |
| Compound Name: | N-(4-methylphenyl)-2-({4-methyl-5-[(thiophen-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 358.48 |
| Molecular Formula: | C17 H18 N4 O S2 |
| Smiles: | Cc1ccc(cc1)NC(CSc1nnc(Cc2cccs2)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8764 |
| logD: | 2.8764 |
| logSw: | -3.288 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.195 |
| InChI Key: | IHPIVBWVMNEXEU-UHFFFAOYSA-N |