2-{1-(3,4-dimethoxyphenyl)-3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
2-{1-(3,4-dimethoxyphenyl)-3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-2,3-dihydro-1H-isoindol-1-one
2-{1-(3,4-dimethoxyphenyl)-3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | E787-0659 |
| Compound Name: | 2-{1-(3,4-dimethoxyphenyl)-3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 503.57 |
| Molecular Formula: | C29 H30 F N3 O4 |
| Smiles: | COc1ccc(cc1OC)C(CC(N1CCN(CC1)c1ccccc1F)=O)N1Cc2ccccc2C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7894 |
| logD: | 3.7894 |
| logSw: | -4.0033 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.317 |
| InChI Key: | RXTYXLMLNGOAJB-VWLOTQADSA-N |