rel-(1R,6S)-8-benzyl-3-[(3,4-difluorophenyl)methyl]-3,8-diazabicyclo[4.2.0]octane
Chemical Structure Depiction of
rel-(1R,6S)-8-benzyl-3-[(3,4-difluorophenyl)methyl]-3,8-diazabicyclo[4.2.0]octane
rel-(1R,6S)-8-benzyl-3-[(3,4-difluorophenyl)methyl]-3,8-diazabicyclo[4.2.0]octane
Compound characteristics
| Compound ID: | S616-0176 |
| Compound Name: | rel-(1R,6S)-8-benzyl-3-[(3,4-difluorophenyl)methyl]-3,8-diazabicyclo[4.2.0]octane |
| Molecular Weight: | 328.4 |
| Molecular Formula: | C20 H22 F2 N2 |
| Smiles: | C1CN(Cc2ccc(c(c2)F)F)C[C@@H]2[C@H]1CN2Cc1ccccc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.5496 |
| logD: | 0.9761 |
| logSw: | -3.5475 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 7.085 |
| InChI Key: | ZHFOKFUCTILSOY-PXNSSMCTSA-N |