dimethyl 4-(2-chloro-6-fluorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(2-chloro-6-fluorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-(2-chloro-6-fluorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | 2556-2132 |
| Compound Name: | dimethyl 4-(2-chloro-6-fluorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 353.78 |
| Molecular Formula: | C17 H17 Cl F N O4 |
| Smiles: | CC1=C(C(C(=C(C)N1)C(=O)OC)c1c(cccc1[Cl])F)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.0386 |
| logD: | -0.7634 |
| logSw: | -3.3633 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.702 |
| InChI Key: | ITTXNNGVEHGVPB-UHFFFAOYSA-N |