{2-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]azepan-1-yl}(2-methoxyphenyl)methanone
Chemical Structure Depiction of
{2-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]azepan-1-yl}(2-methoxyphenyl)methanone
{2-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]azepan-1-yl}(2-methoxyphenyl)methanone
Compound characteristics
| Compound ID: | S534-0961 |
| Compound Name: | {2-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]azepan-1-yl}(2-methoxyphenyl)methanone |
| Molecular Weight: | 378.51 |
| Molecular Formula: | C24 H30 N2 O2 |
| Smiles: | COc1ccccc1C(N1CCCCCC1CN1CCc2ccccc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0817 |
| logD: | 4.0467 |
| logSw: | -4.2258 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.8889 |
| InChI Key: | YZDZDLIIOJWSMM-OAQYLSRUSA-N |