N-(2-fluorophenyl)-2-(2-{[(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(4-hydroxy-3-methoxyphenyl)methyl]amino}-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamide
Chemical Structure Depiction of
N-(2-fluorophenyl)-2-(2-{[(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(4-hydroxy-3-methoxyphenyl)methyl]amino}-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamide
N-(2-fluorophenyl)-2-(2-{[(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(4-hydroxy-3-methoxyphenyl)methyl]amino}-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamide
Compound characteristics
| Compound ID: | E755-0223 |
| Compound Name: | N-(2-fluorophenyl)-2-(2-{[(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(4-hydroxy-3-methoxyphenyl)methyl]amino}-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamide |
| Molecular Weight: | 529.5 |
| Molecular Formula: | C23 H20 F N5 O7 S |
| Smiles: | COc1cc(ccc1O)C(C1=C(NC(NC1=O)=O)O)NC1=NC(C(CC(Nc2ccccc2F)=O)S1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.0413 |
| logD: | -4.2569 |
| logSw: | -2.2797 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 6 |
| Polar surface area: | 143.711 |
| InChI Key: | IBKURDYOMOQVGR-UHFFFAOYSA-N |