2-[2-({[4-(dimethylamino)phenyl](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-(3-fluoro-4-methylphenyl)acetamide
Chemical Structure Depiction of
2-[2-({[4-(dimethylamino)phenyl](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-(3-fluoro-4-methylphenyl)acetamide
2-[2-({[4-(dimethylamino)phenyl](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-(3-fluoro-4-methylphenyl)acetamide
Compound characteristics
| Compound ID: | C202-2070 |
| Compound Name: | 2-[2-({[4-(dimethylamino)phenyl](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-(3-fluoro-4-methylphenyl)acetamide |
| Molecular Weight: | 600.63 |
| Molecular Formula: | C25 H25 F N6 O5 S |
| Salt: | CH3COOH |
| Smiles: | Cc1ccc(cc1F)NC(CC1C(N=C(NC(C2=C(NC(NC2=O)=O)O)c2ccc(cc2)N(C)C)S1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.6566 |
| logD: | -2.6417 |
| logSw: | -2.5021 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 123.035 |
| InChI Key: | CONAHNWNEISPBE-UHFFFAOYSA-N |