methyl 6-(chloromethyl)-4-(3,4-dimethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 6-(chloromethyl)-4-(3,4-dimethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 6-(chloromethyl)-4-(3,4-dimethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
Compound ID: | S553-0583 |
Compound Name: | methyl 6-(chloromethyl)-4-(3,4-dimethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
Molecular Weight: | 340.76 |
Molecular Formula: | C15 H17 Cl N2 O5 |
Smiles: | COC(C1C(c2ccc(c(c2)OC)OC)NC(NC=1C[Cl])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.3195 |
logD: | 0.0488 |
logSw: | -2.0498 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.733 |
InChI Key: | LBBANOQVHDCSHX-CYBMUJFWSA-N |