1-benzyl-3-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]azepan-2-one
Chemical Structure Depiction of
1-benzyl-3-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]azepan-2-one
1-benzyl-3-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]azepan-2-one
Compound characteristics
| Compound ID: | S581-0937 |
| Compound Name: | 1-benzyl-3-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]azepan-2-one |
| Molecular Weight: | 376.5 |
| Molecular Formula: | C24 H28 N2 O2 |
| Smiles: | C1CCN(Cc2ccccc2)C(C(C1)CC(N1CCc2ccccc2C1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5946 |
| logD: | 3.5946 |
| logSw: | -3.393 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.971 |
| InChI Key: | SDKXMNARPWIYIT-OAQYLSRUSA-N |