methyl 6-[(2,5-dimethoxybenzene-1-sulfonyl)methyl]-4-(4-hydroxy-3-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 6-[(2,5-dimethoxybenzene-1-sulfonyl)methyl]-4-(4-hydroxy-3-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 6-[(2,5-dimethoxybenzene-1-sulfonyl)methyl]-4-(4-hydroxy-3-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | C653-0562 |
| Compound Name: | methyl 6-[(2,5-dimethoxybenzene-1-sulfonyl)methyl]-4-(4-hydroxy-3-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 492.5 |
| Molecular Formula: | C22 H24 N2 O9 S |
| Smiles: | COC(C1C(c2ccc(c(c2)OC)O)NC(NC=1CS(c1cc(ccc1OC)OC)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3094 |
| logD: | 0.8837 |
| logSw: | -2.166 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 125.59 |
| InChI Key: | DHKLYHFZVJVUCG-HXUWFJFHSA-N |