ethyl 6-[(4-chlorobenzene-1-sulfonyl)methyl]-4-(3,4-dimethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-[(4-chlorobenzene-1-sulfonyl)methyl]-4-(3,4-dimethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-[(4-chlorobenzene-1-sulfonyl)methyl]-4-(3,4-dimethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | C653-0044 |
| Compound Name: | ethyl 6-[(4-chlorobenzene-1-sulfonyl)methyl]-4-(3,4-dimethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 494.95 |
| Molecular Formula: | C22 H23 Cl N2 O7 S |
| Smiles: | CCOC(C1C(c2ccc(c(c2)OC)OC)NC(NC=1CS(c1ccc(cc1)[Cl])(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6824 |
| logD: | 2.2567 |
| logSw: | -3.6485 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.078 |
| InChI Key: | PILAEZKOTUJXAH-HXUWFJFHSA-N |