N-{[4-(dimethylamino)phenyl]methyl}-2-(2-methoxyethyl)-3-oxo-1,2,3,4-tetrahydroisoquinoline-1-carboxamide
Chemical Structure Depiction of
N-{[4-(dimethylamino)phenyl]methyl}-2-(2-methoxyethyl)-3-oxo-1,2,3,4-tetrahydroisoquinoline-1-carboxamide
N-{[4-(dimethylamino)phenyl]methyl}-2-(2-methoxyethyl)-3-oxo-1,2,3,4-tetrahydroisoquinoline-1-carboxamide
Compound characteristics
| Compound ID: | M575-1333 |
| Compound Name: | N-{[4-(dimethylamino)phenyl]methyl}-2-(2-methoxyethyl)-3-oxo-1,2,3,4-tetrahydroisoquinoline-1-carboxamide |
| Molecular Weight: | 381.47 |
| Molecular Formula: | C22 H27 N3 O3 |
| Smiles: | CN(C)c1ccc(CNC(C2c3ccccc3CC(N2CCOC)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1325 |
| logD: | 2.1171 |
| logSw: | -2.6677 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.011 |
| InChI Key: | MYSCWKORAMNLES-OAQYLSRUSA-N |