N-benzyl-2-[(4-ethoxyphenyl)methyl]-3-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Chemical Structure Depiction of
N-benzyl-2-[(4-ethoxyphenyl)methyl]-3-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
N-benzyl-2-[(4-ethoxyphenyl)methyl]-3-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Compound characteristics
| Compound ID: | L678-0378 |
| Compound Name: | N-benzyl-2-[(4-ethoxyphenyl)methyl]-3-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
| Molecular Weight: | 428.53 |
| Molecular Formula: | C27 H28 N2 O3 |
| Smiles: | CCOc1ccc(CN2C(c3ccccc3CC2(C)C(NCc2ccccc2)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9716 |
| logD: | 4.9716 |
| logSw: | -4.5852 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.47 |
| InChI Key: | YHIFHEMEUMQLFS-MHZLTWQESA-N |