dimethyl 1-benzyl-4-(2,5-difluorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-benzyl-4-(2,5-difluorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 1-benzyl-4-(2,5-difluorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K813-0087 |
| Compound Name: | dimethyl 1-benzyl-4-(2,5-difluorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 399.39 |
| Molecular Formula: | C22 H19 F2 N O4 |
| Smiles: | COC(C1=CN(Cc2ccccc2)C=C(C1c1cc(ccc1F)F)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9516 |
| logD: | 3.9516 |
| logSw: | -4.0762 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.277 |
| InChI Key: | SNABIVAIEAPJQO-UHFFFAOYSA-N |