2-(4-chlorophenyl)-3-[(2,5-dimethylphenyl)methyl]-5-(2-hydroxyethyl)-6-methylpyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-3-[(2,5-dimethylphenyl)methyl]-5-(2-hydroxyethyl)-6-methylpyrimidin-4(3H)-one
2-(4-chlorophenyl)-3-[(2,5-dimethylphenyl)methyl]-5-(2-hydroxyethyl)-6-methylpyrimidin-4(3H)-one
Compound characteristics
Compound ID: | T604-0407 |
Compound Name: | 2-(4-chlorophenyl)-3-[(2,5-dimethylphenyl)methyl]-5-(2-hydroxyethyl)-6-methylpyrimidin-4(3H)-one |
Molecular Weight: | 382.89 |
Molecular Formula: | C22 H23 Cl N2 O2 |
Smiles: | CC1=C(CCO)C(N(Cc2cc(C)ccc2C)C(c2ccc(cc2)[Cl])=N1)=O |
Stereo: | ACHIRAL |
logP: | 4.296 |
logD: | 4.2955 |
logSw: | -4.4872 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 41.657 |
InChI Key: | CZHMTVLIZVOHQQ-UHFFFAOYSA-N |