(5-methylpyridin-2-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-2-yl){rel-(1R,6S)-8-[(pyridin-3-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone
(5-methylpyridin-2-yl){rel-(1R,6S)-8-[(pyridin-3-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone
Compound characteristics
| Compound ID: | S616-4422 |
| Compound Name: | (5-methylpyridin-2-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: | Cc1ccc(C(N2CC[C@@H]3CN(Cc4cccnc4)[C@@H]3C2)=O)nc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.3981 |
| logD: | 0.2069 |
| logSw: | -0.8717 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.656 |
| InChI Key: | WIERJIZXVZQORR-WMZOPIPTSA-N |