N-(2-fluorophenyl)-2-(2-{[(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(4-hydroxyphenyl)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-hydroxyphenyl)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-hydroxyphenyl)methyl]amino}-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamide
Compound characteristics
| Compound ID: | E755-0161 |
| Compound Name: | N-(2-fluorophenyl)-2-(2-{[(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(4-hydroxyphenyl)methyl]amino}-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamide |
| Molecular Weight: | 499.48 |
| Molecular Formula: | C22 H18 F N5 O6 S |
| Smiles: | C(C1C(N=C(NC(C2=C(NC(NC2=O)=O)O)c2ccc(cc2)O)S1)=O)C(Nc1ccccc1F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.0771 |
| logD: | -4.2211 |
| logSw: | -2.1031 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 6 |
| Polar surface area: | 137.149 |
| InChI Key: | LOKIWXUCONXTFY-UHFFFAOYSA-N |