2-(ethylsulfanyl)ethyl 4-(3,4-dichlorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
2-(ethylsulfanyl)ethyl 4-(3,4-dichlorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
2-(ethylsulfanyl)ethyl 4-(3,4-dichlorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
Compound ID: | 1834-0064 |
Compound Name: | 2-(ethylsulfanyl)ethyl 4-(3,4-dichlorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
Molecular Weight: | 403.33 |
Molecular Formula: | C17 H20 Cl2 N2 O3 S |
Smiles: | CCSCCOC(C1C(c2ccc(c(c2)[Cl])[Cl])NC(N(C)C=1C)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.0835 |
logD: | 4.0758 |
logSw: | -4.5259 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.723 |
InChI Key: | JCZAODOAPHKXLZ-HNNXBMFYSA-N |