N-{2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(dimethylamino)phenyl]ethyl}adamantane-1-carboxamide
Chemical Structure Depiction of
N-{2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(dimethylamino)phenyl]ethyl}adamantane-1-carboxamide
N-{2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(dimethylamino)phenyl]ethyl}adamantane-1-carboxamide
Compound characteristics
| Compound ID: | G500-0919 |
| Compound Name: | N-{2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(dimethylamino)phenyl]ethyl}adamantane-1-carboxamide |
| Molecular Weight: | 457.66 |
| Molecular Formula: | C30 H39 N3 O |
| Smiles: | CN(C)c1ccc(cc1)C(CNC(C12CC3CC(CC(C3)C2)C1)=O)N1CCc2ccccc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.219 |
| logD: | 6.1536 |
| logSw: | -5.699 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.1411 |
| InChI Key: | DCZOQFUGOXCDJN-TXDHVUEDSA-N |