rel-(1R,6S)-8-benzyl-3-[(2,3-dihydro-1-benzofuran-5-yl)methyl]-3,8-diazabicyclo[4.2.0]octane
Chemical Structure Depiction of
rel-(1R,6S)-8-benzyl-3-[(2,3-dihydro-1-benzofuran-5-yl)methyl]-3,8-diazabicyclo[4.2.0]octane
rel-(1R,6S)-8-benzyl-3-[(2,3-dihydro-1-benzofuran-5-yl)methyl]-3,8-diazabicyclo[4.2.0]octane
Compound characteristics
| Compound ID: | S616-0196 |
| Compound Name: | rel-(1R,6S)-8-benzyl-3-[(2,3-dihydro-1-benzofuran-5-yl)methyl]-3,8-diazabicyclo[4.2.0]octane |
| Molecular Weight: | 334.46 |
| Molecular Formula: | C22 H26 N2 O |
| Smiles: | C1COc2ccc(CN3CC[C@@H]4CN(Cc5ccccc5)[C@@H]4C3)cc12 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.3226 |
| logD: | 0.7491 |
| logSw: | -3.3072 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 15.3229 |
| InChI Key: | OEKJHMYCTXJPRU-NHCUHLMSSA-N |