4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1(2H)-one
Chemical Structure Depiction of
4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1(2H)-one
4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C066-0780 |
| Compound Name: | 4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1(2H)-one |
| Molecular Weight: | 565.65 |
| Molecular Formula: | C34 H32 F N3 O4 |
| Smiles: | COc1ccc(cc1)C1C(C(N2CCN(CC2)c2ccc(cc2)F)=O)c2ccccc2C(N1c1ccc(cc1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4824 |
| logD: | 5.4824 |
| logSw: | -5.5641 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.036 |
| InChI Key: | NIXFTPNRSMNAIJ-UHFFFAOYSA-N |