dimethyl 4-(4-chloro-3-nitrophenyl)-1-cyclopropyl-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(4-chloro-3-nitrophenyl)-1-cyclopropyl-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 4-(4-chloro-3-nitrophenyl)-1-cyclopropyl-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | 8013-8774 |
| Compound Name: | dimethyl 4-(4-chloro-3-nitrophenyl)-1-cyclopropyl-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 392.79 |
| Molecular Formula: | C18 H17 Cl N2 O6 |
| Smiles: | COC(C1=CN(C=C(C1c1ccc(c(c1)[N+]([O-])=O)[Cl])C(=O)OC)C1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7657 |
| logD: | 2.7657 |
| logSw: | -3.5685 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.241 |
| InChI Key: | LSYBJPYXPRXZQG-UHFFFAOYSA-N |