dimethyl 1-[(4-chlorophenyl)methyl]-4-(4-methyl-3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-[(4-chlorophenyl)methyl]-4-(4-methyl-3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 1-[(4-chlorophenyl)methyl]-4-(4-methyl-3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-1134 |
| Compound Name: | dimethyl 1-[(4-chlorophenyl)methyl]-4-(4-methyl-3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 456.88 |
| Molecular Formula: | C23 H21 Cl N2 O6 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C1C(=CN(Cc2ccc(cc2)[Cl])C=C1C(=O)OC)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.5327 |
| logD: | 4.5327 |
| logSw: | -4.9776 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.357 |
| InChI Key: | RXWJETURUNDTOH-UHFFFAOYSA-N |