ethyl 6-[(3,4-dimethylbenzene-1-sulfonyl)methyl]-4-(4-hydroxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-[(3,4-dimethylbenzene-1-sulfonyl)methyl]-4-(4-hydroxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-[(3,4-dimethylbenzene-1-sulfonyl)methyl]-4-(4-hydroxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | C653-0126 |
| Compound Name: | ethyl 6-[(3,4-dimethylbenzene-1-sulfonyl)methyl]-4-(4-hydroxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 444.51 |
| Molecular Formula: | C22 H24 N2 O6 S |
| Smiles: | CCOC(C1C(c2ccc(cc2)O)NC(NC=1CS(c1ccc(C)c(C)c1)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6682 |
| logD: | 2.2424 |
| logSw: | -2.8663 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 103.434 |
| InChI Key: | UGWXCSWOPVXWNJ-FQEVSTJZSA-N |