2-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxo-1-(thiophen-2-yl)propyl}-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
2-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxo-1-(thiophen-2-yl)propyl}-2,3-dihydro-1H-isoindol-1-one
2-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxo-1-(thiophen-2-yl)propyl}-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | E787-0365 |
| Compound Name: | 2-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxo-1-(thiophen-2-yl)propyl}-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C25 H24 F N3 O2 S |
| Smiles: | C(C(c1cccs1)N1Cc2ccccc2C1=O)C(N1CCN(CC1)c1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7446 |
| logD: | 3.7446 |
| logSw: | -4.0861 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.375 |
| InChI Key: | XDTUCPPCMYOFHB-QFIPXVFZSA-N |