{rel-(1R,6S)-8-[(pyridin-3-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}(quinolin-2-yl)methanone
Chemical Structure Depiction of
{rel-(1R,6S)-8-[(pyridin-3-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}(quinolin-2-yl)methanone
{rel-(1R,6S)-8-[(pyridin-3-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}(quinolin-2-yl)methanone
Compound characteristics
| Compound ID: | S616-0405 |
| Compound Name: | {rel-(1R,6S)-8-[(pyridin-3-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}(quinolin-2-yl)methanone |
| Molecular Weight: | 358.44 |
| Molecular Formula: | C22 H22 N4 O |
| Smiles: | C1CN(C[C@@H]2[C@H]1CN2Cc1cccnc1)C(c1ccc2ccccc2n1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.2128 |
| logD: | 1.0216 |
| logSw: | -2.2538 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.849 |
| InChI Key: | BQNLELQYFULZOU-RXVVDRJESA-N |