dimethyl 1-(adamantan-1-yl)-4-{2-[(propan-2-yl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-(adamantan-1-yl)-4-{2-[(propan-2-yl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate
dimethyl 1-(adamantan-1-yl)-4-{2-[(propan-2-yl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
Compound ID: | 5071-7798 |
Compound Name: | dimethyl 1-(adamantan-1-yl)-4-{2-[(propan-2-yl)oxy]phenyl}-1,4-dihydropyridine-3,5-dicarboxylate |
Molecular Weight: | 465.59 |
Molecular Formula: | C28 H35 N O5 |
Smiles: | CC(C)Oc1ccccc1C1C(=CN(C=C1C(=O)OC)C12CC3CC(CC(C3)C2)C1)C(=O)OC |
Stereo: | ACHIRAL |
logP: | 5.3804 |
logD: | 5.3804 |
logSw: | -5.53 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 51.578 |
InChI Key: | SKBNLQYGYRBVQE-UHFFFAOYSA-N |