dimethyl 1-[(4-chlorophenyl)methyl]-4-(5-methylthiophen-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-[(4-chlorophenyl)methyl]-4-(5-methylthiophen-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 1-[(4-chlorophenyl)methyl]-4-(5-methylthiophen-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K837-1397 |
| Compound Name: | dimethyl 1-[(4-chlorophenyl)methyl]-4-(5-methylthiophen-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 417.91 |
| Molecular Formula: | C21 H20 Cl N O4 S |
| Smiles: | Cc1ccc(C2C(=CN(Cc3ccc(cc3)[Cl])C=C2C(=O)OC)C(=O)OC)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.5434 |
| logD: | 4.5434 |
| logSw: | -4.7089 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.295 |
| InChI Key: | GLQBOWWAHUMDQP-UHFFFAOYSA-N |