methyl 6-[(3-chloro-4-methoxybenzene-1-sulfonyl)methyl]-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 6-[(3-chloro-4-methoxybenzene-1-sulfonyl)methyl]-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 6-[(3-chloro-4-methoxybenzene-1-sulfonyl)methyl]-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | C653-0305 |
| Compound Name: | methyl 6-[(3-chloro-4-methoxybenzene-1-sulfonyl)methyl]-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 450.9 |
| Molecular Formula: | C20 H19 Cl N2 O6 S |
| Smiles: | COC(C1C(c2ccccc2)NC(NC=1CS(c1ccc(c(c1)[Cl])OC)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1032 |
| logD: | 1.6774 |
| logSw: | -3.0715 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.868 |
| InChI Key: | BEYMCZJGHRVIFN-GOSISDBHSA-N |