ethyl 6-[(4-fluorobenzene-1-sulfonyl)methyl]-4-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-[(4-fluorobenzene-1-sulfonyl)methyl]-4-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-[(4-fluorobenzene-1-sulfonyl)methyl]-4-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | C653-0196 |
| Compound Name: | ethyl 6-[(4-fluorobenzene-1-sulfonyl)methyl]-4-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 432.47 |
| Molecular Formula: | C21 H21 F N2 O5 S |
| Smiles: | CCOC(C1C(c2ccc(C)cc2)NC(NC=1CS(c1ccc(cc1)F)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7789 |
| logD: | 2.3532 |
| logSw: | -3.2668 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.817 |
| InChI Key: | AADMGXKPFLOYBV-LJQANCHMSA-N |