ethyl 6-[(4-fluoro-3-methylbenzene-1-sulfonyl)methyl]-4-(4-hydroxy-3-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-[(4-fluoro-3-methylbenzene-1-sulfonyl)methyl]-4-(4-hydroxy-3-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-[(4-fluoro-3-methylbenzene-1-sulfonyl)methyl]-4-(4-hydroxy-3-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | C653-0221 |
| Compound Name: | ethyl 6-[(4-fluoro-3-methylbenzene-1-sulfonyl)methyl]-4-(4-hydroxy-3-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 478.5 |
| Molecular Formula: | C22 H23 F N2 O7 S |
| Smiles: | CCOC(C1C(c2ccc(c(c2)OC)O)NC(NC=1CS(c1ccc(c(C)c1)F)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1028 |
| logD: | 1.677 |
| logSw: | -2.7684 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 109.995 |
| InChI Key: | UGOJUFOJTZQNOC-HXUWFJFHSA-N |