N-{[5-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}-2-phenoxyacetamide
Chemical Structure Depiction of
N-{[5-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}-2-phenoxyacetamide
N-{[5-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}-2-phenoxyacetamide
Compound characteristics
| Compound ID: | C592-3428 |
| Compound Name: | N-{[5-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}-2-phenoxyacetamide |
| Molecular Weight: | 480.57 |
| Molecular Formula: | C22 H20 N6 O3 S2 |
| Smiles: | C(c1nnc(n1c1ccccc1)SCC(Nc1nccs1)=O)NC(COc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5014 |
| logD: | 2.501 |
| logSw: | -2.7272 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.287 |
| InChI Key: | GEBPRDBSDYJJHB-UHFFFAOYSA-N |