2-{3-[(2-chlorophenyl)methyl]-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl}-N-(3,5-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-{3-[(2-chlorophenyl)methyl]-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl}-N-(3,5-dimethylphenyl)acetamide
2-{3-[(2-chlorophenyl)methyl]-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl}-N-(3,5-dimethylphenyl)acetamide
Compound characteristics
Compound ID: | D702-0666 |
Compound Name: | 2-{3-[(2-chlorophenyl)methyl]-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl}-N-(3,5-dimethylphenyl)acetamide |
Molecular Weight: | 397.86 |
Molecular Formula: | C21 H20 Cl N3 O3 |
Smiles: | Cc1cc(C)cc(c1)NC(CN1C(C=CN(Cc2ccccc2[Cl])C1=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.4708 |
logD: | 3.4708 |
logSw: | -3.6139 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.306 |
InChI Key: | MYIKQOWAHDUCNW-UHFFFAOYSA-N |