2-{[2-benzoyl-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{[2-benzoyl-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(pyrrolidin-1-yl)ethan-1-one
2-{[2-benzoyl-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | V023-5199 |
| Compound Name: | 2-{[2-benzoyl-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 454.57 |
| Molecular Formula: | C29 H30 N2 O3 |
| Smiles: | Cc1cccc(c1)C1c2cc(ccc2CCN1C(c1ccccc1)=O)OCC(N1CCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0756 |
| logD: | 5.0756 |
| logSw: | -4.8541 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.847 |
| InChI Key: | OTJRSDQXKMEEHG-NDEPHWFRSA-N |