(5-methylpyridin-3-yl){rel-(1R,6S)-8-[(pyridin-3-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone
Chemical Structure Depiction of
(5-methylpyridin-3-yl){rel-(1R,6S)-8-[(pyridin-3-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone
(5-methylpyridin-3-yl){rel-(1R,6S)-8-[(pyridin-3-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone
Compound characteristics
| Compound ID: | S616-8539 |
| Compound Name: | (5-methylpyridin-3-yl){rel-(1R,6S)-8-[(pyridin-3-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone |
| Molecular Weight: | 322.41 |
| Molecular Formula: | C19 H22 N4 O |
| Smiles: | Cc1cc(cnc1)C(N1CC[C@@H]2CN(Cc3cccnc3)[C@@H]2C1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.7501 |
| logD: | -0.1354 |
| logSw: | -0.7416 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.126 |
| InChI Key: | KSOIVWAATTVWCK-WMZOPIPTSA-N |