dimethyl 1-{2-[(adamantan-1-yl)oxy]ethyl}-4-(4-hydroxy-3,5-dimethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-{2-[(adamantan-1-yl)oxy]ethyl}-4-(4-hydroxy-3,5-dimethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 1-{2-[(adamantan-1-yl)oxy]ethyl}-4-(4-hydroxy-3,5-dimethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | 8015-0054 |
| Compound Name: | dimethyl 1-{2-[(adamantan-1-yl)oxy]ethyl}-4-(4-hydroxy-3,5-dimethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 527.62 |
| Molecular Formula: | C29 H37 N O8 |
| Smiles: | COC(C1=CN(CCOC23CC4CC(CC(C4)C3)C2)C=C(C1c1cc(c(c(c1)OC)O)OC)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9222 |
| logD: | 3.9213 |
| logSw: | -3.7999 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.256 |
| InChI Key: | BQFQBZRWCZWWEE-UHFFFAOYSA-N |