2-{[5-(1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]acetamide
Chemical Structure Depiction of
2-{[5-(1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]acetamide
2-{[5-(1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]acetamide
Compound characteristics
| Compound ID: | J047-0012 |
| Compound Name: | 2-{[5-(1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]acetamide |
| Molecular Weight: | 461.56 |
| Molecular Formula: | C23 H19 N5 O2 S2 |
| Smiles: | Cc1ccc(cc1)c1csc(NC(CSc2nnc(c3cc4ccccc4o3)n2C)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.7918 |
| logD: | 5.7918 |
| logSw: | -6.2345 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.268 |
| InChI Key: | CSUPTFSMYYUOKY-UHFFFAOYSA-N |