dimethyl 4-(3-ethoxy-4-hydroxyphenyl)-1-[(oxolan-2-yl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(3-ethoxy-4-hydroxyphenyl)-1-[(oxolan-2-yl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-(3-ethoxy-4-hydroxyphenyl)-1-[(oxolan-2-yl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
Compound ID: | 5198-8127 |
Compound Name: | dimethyl 4-(3-ethoxy-4-hydroxyphenyl)-1-[(oxolan-2-yl)methyl]-1,4-dihydropyridine-3,5-dicarboxylate |
Molecular Weight: | 417.46 |
Molecular Formula: | C22 H27 N O7 |
Smiles: | CCOc1cc(ccc1O)C1C(=CN(CC2CCCO2)C=C1C(=O)OC)C(=O)OC |
Stereo: | RACEMIC MIXTURE |
logP: | 1.8843 |
logD: | 1.8841 |
logSw: | -2.1776 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 77.689 |
InChI Key: | NZVMZTJZEPCQRB-OAHLLOKOSA-N |