ethyl 6-[(4-chlorobenzene-1-sulfonyl)methyl]-4-(4-ethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-[(4-chlorobenzene-1-sulfonyl)methyl]-4-(4-ethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-[(4-chlorobenzene-1-sulfonyl)methyl]-4-(4-ethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | C653-0062 |
| Compound Name: | ethyl 6-[(4-chlorobenzene-1-sulfonyl)methyl]-4-(4-ethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 478.95 |
| Molecular Formula: | C22 H23 Cl N2 O6 S |
| Smiles: | CCOC(C1C(c2ccc(cc2)OCC)NC(NC=1CS(c1ccc(cc1)[Cl])(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2902 |
| logD: | 2.8644 |
| logSw: | -3.9705 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.94 |
| InChI Key: | IBIWEEPWNCMZDT-HXUWFJFHSA-N |