2-({4-(2,5-dimethylphenyl)-5-[(2-phenoxyacetamido)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(1,3-thiazol-2-yl)acetamide
Chemical Structure Depiction of
2-({4-(2,5-dimethylphenyl)-5-[(2-phenoxyacetamido)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(1,3-thiazol-2-yl)acetamide
2-({4-(2,5-dimethylphenyl)-5-[(2-phenoxyacetamido)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(1,3-thiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | A0062271 |
| Compound Name: | 2-({4-(2,5-dimethylphenyl)-5-[(2-phenoxyacetamido)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(1,3-thiazol-2-yl)acetamide |
| Molecular Weight: | 508.62 |
| Molecular Formula: | C24 H24 N6 O3 S2 |
| Smiles: | Cc1ccc(C)c(c1)n1c(CNC(COc2ccccc2)=O)nnc1SCC(Nc1nccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.556 |
| logD: | 3.5555 |
| logSw: | -3.8799 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.986 |
| InChI Key: | SLKIBOVXEVTSFS-UHFFFAOYSA-N |