7-benzyl-7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)azepan-2-one
Chemical Structure Depiction of
7-benzyl-7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)azepan-2-one
7-benzyl-7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)azepan-2-one
Compound characteristics
| Compound ID: | S515-0593 |
| Compound Name: | 7-benzyl-7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)azepan-2-one |
| Molecular Weight: | 362.47 |
| Molecular Formula: | C23 H26 N2 O2 |
| Smiles: | C1CCC(Cc2ccccc2)(C(N2CCc3ccccc3C2)=O)NC(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2187 |
| logD: | 3.2187 |
| logSw: | -3.1761 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.652 |
| InChI Key: | XGNCJBXMLJKRSG-HSZRJFAPSA-N |