2,2,2-trichloroethyl 4-(3,4-dimethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
2,2,2-trichloroethyl 4-(3,4-dimethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
2,2,2-trichloroethyl 4-(3,4-dimethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
Compound ID: | 2648-4229 |
Compound Name: | 2,2,2-trichloroethyl 4-(3,4-dimethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
Molecular Weight: | 423.68 |
Molecular Formula: | C16 H17 Cl3 N2 O5 |
Smiles: | CC1=C(C(c2ccc(c(c2)OC)OC)NC(N1)=O)C(=O)OCC([Cl])([Cl])[Cl] |
Stereo: | RACEMIC MIXTURE |
logP: | 2.4308 |
logD: | 2.2805 |
logSw: | -3.352 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.082 |
InChI Key: | WYPKBECYWYDJDH-ZDUSSCGKSA-N |