3-methylbutyl 4-(3,4-dichlorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
3-methylbutyl 4-(3,4-dichlorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
3-methylbutyl 4-(3,4-dichlorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
Compound ID: | 1630-1740 |
Compound Name: | 3-methylbutyl 4-(3,4-dichlorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
Molecular Weight: | 385.29 |
Molecular Formula: | C18 H22 Cl2 N2 O3 |
Smiles: | CC(C)CCOC(C1C(c2ccc(c(c2)[Cl])[Cl])NC(N(C)C=1C)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.8159 |
logD: | 4.8082 |
logSw: | -5.0064 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.723 |
InChI Key: | ANYSNVIXMHPKQV-INIZCTEOSA-N |