ethyl 4-(2H-1,3-benzodioxol-5-yl)-6-[(4-methylphenoxy)methyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(2H-1,3-benzodioxol-5-yl)-6-[(4-methylphenoxy)methyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(2H-1,3-benzodioxol-5-yl)-6-[(4-methylphenoxy)methyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
Compound ID: | 8015-7951 |
Compound Name: | ethyl 4-(2H-1,3-benzodioxol-5-yl)-6-[(4-methylphenoxy)methyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
Molecular Weight: | 410.43 |
Molecular Formula: | C22 H22 N2 O6 |
Smiles: | CCOC(C1C(c2ccc3c(c2)OCO3)NC(NC=1COc1ccc(C)cc1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.5817 |
logD: | 3.3181 |
logSw: | -3.5743 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 81.395 |
InChI Key: | JSIZYHHHEIKJHC-HXUWFJFHSA-N |