2-(2-{[(2-ethoxyphenyl)(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)methyl]amino}-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-(2-{[(2-ethoxyphenyl)(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)methyl]amino}-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)-N-(4-fluorophenyl)acetamide
2-(2-{[(2-ethoxyphenyl)(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)methyl]amino}-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | E755-0591 |
| Compound Name: | 2-(2-{[(2-ethoxyphenyl)(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)methyl]amino}-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 527.53 |
| Molecular Formula: | C24 H22 F N5 O6 S |
| Smiles: | CCOc1ccccc1C(C1=C(NC(NC1=O)=O)O)NC1=NC(C(CC(Nc2ccc(cc2)F)=O)S1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.5868 |
| logD: | -2.7114 |
| logSw: | -2.3291 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 127.44 |
| InChI Key: | ZMPRKXGFWLLLPI-UHFFFAOYSA-N |