1-[1-(4-fluorophenyl)-7-{[5-(4-methylpiperazine-1-carbonyl)furan-2-yl]methoxy}-3,4-dihydroisoquinolin-2(1H)-yl]-2-methylpropan-1-one
Chemical Structure Depiction of
1-[1-(4-fluorophenyl)-7-{[5-(4-methylpiperazine-1-carbonyl)furan-2-yl]methoxy}-3,4-dihydroisoquinolin-2(1H)-yl]-2-methylpropan-1-one
1-[1-(4-fluorophenyl)-7-{[5-(4-methylpiperazine-1-carbonyl)furan-2-yl]methoxy}-3,4-dihydroisoquinolin-2(1H)-yl]-2-methylpropan-1-one
Compound characteristics
| Compound ID: | V021-7904 |
| Compound Name: | 1-[1-(4-fluorophenyl)-7-{[5-(4-methylpiperazine-1-carbonyl)furan-2-yl]methoxy}-3,4-dihydroisoquinolin-2(1H)-yl]-2-methylpropan-1-one |
| Molecular Weight: | 519.62 |
| Molecular Formula: | C30 H34 F N3 O4 |
| Smiles: | CC(C)C(N1CCc2ccc(cc2C1c1ccc(cc1)F)OCc1ccc(C(N2CCN(C)CC2)=O)o1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6148 |
| logD: | 4.487 |
| logSw: | -4.4754 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.327 |
| InChI Key: | XKRSNSHCPRMHBP-NDEPHWFRSA-N |