dimethyl 1-[(thiophen-2-yl)methyl]-4-(2,3,4-trimethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-[(thiophen-2-yl)methyl]-4-(2,3,4-trimethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 1-[(thiophen-2-yl)methyl]-4-(2,3,4-trimethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | K813-0122 |
| Compound Name: | dimethyl 1-[(thiophen-2-yl)methyl]-4-(2,3,4-trimethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 459.52 |
| Molecular Formula: | C23 H25 N O7 S |
| Smiles: | COC(C1=CN(Cc2cccs2)C=C(C1c1ccc(c(c1OC)OC)OC)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.321 |
| logD: | 3.321 |
| logSw: | -3.4524 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.36 |
| InChI Key: | CUSSPRJGJDGLFV-UHFFFAOYSA-N |