3-(4-fluorophenyl)-4-[4-(2-fluorophenyl)piperazine-1-carbonyl]-2-(2-methoxyethyl)-3,4-dihydroisoquinolin-1(2H)-one
Chemical Structure Depiction of
3-(4-fluorophenyl)-4-[4-(2-fluorophenyl)piperazine-1-carbonyl]-2-(2-methoxyethyl)-3,4-dihydroisoquinolin-1(2H)-one
3-(4-fluorophenyl)-4-[4-(2-fluorophenyl)piperazine-1-carbonyl]-2-(2-methoxyethyl)-3,4-dihydroisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C096-0738 |
| Compound Name: | 3-(4-fluorophenyl)-4-[4-(2-fluorophenyl)piperazine-1-carbonyl]-2-(2-methoxyethyl)-3,4-dihydroisoquinolin-1(2H)-one |
| Molecular Weight: | 505.56 |
| Molecular Formula: | C29 H29 F2 N3 O3 |
| Smiles: | COCCN1C(C(C(N2CCN(CC2)c2ccccc2F)=O)c2ccccc2C1=O)c1ccc(cc1)F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0693 |
| logD: | 4.0693 |
| logSw: | -4.2609 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.851 |
| InChI Key: | OJKYUBMJIXMTEO-UHFFFAOYSA-N |