2-{1-[4-(4-fluorophenyl)piperazin-1-yl]-4-(methanesulfonyl)-1-oxobutan-2-yl}-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
2-{1-[4-(4-fluorophenyl)piperazin-1-yl]-4-(methanesulfonyl)-1-oxobutan-2-yl}-2,3-dihydro-1H-isoindol-1-one
2-{1-[4-(4-fluorophenyl)piperazin-1-yl]-4-(methanesulfonyl)-1-oxobutan-2-yl}-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | E612-1153 |
| Compound Name: | 2-{1-[4-(4-fluorophenyl)piperazin-1-yl]-4-(methanesulfonyl)-1-oxobutan-2-yl}-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 459.54 |
| Molecular Formula: | C23 H26 F N3 O4 S |
| Smiles: | CS(CCC(C(N1CCN(CC1)c1ccc(cc1)F)=O)N1Cc2ccccc2C1=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6014 |
| logD: | 1.6014 |
| logSw: | -2.5977 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.169 |
| InChI Key: | PKMXREWXODDPAM-NRFANRHFSA-N |