(1H-indol-2-yl){rel-(1R,6S)-8-[(pyridin-3-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone
Chemical Structure Depiction of
(1H-indol-2-yl){rel-(1R,6S)-8-[(pyridin-3-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone
(1H-indol-2-yl){rel-(1R,6S)-8-[(pyridin-3-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone
Compound characteristics
| Compound ID: | S616-0394 |
| Compound Name: | (1H-indol-2-yl){rel-(1R,6S)-8-[(pyridin-3-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone |
| Molecular Weight: | 346.43 |
| Molecular Formula: | C21 H22 N4 O |
| Smiles: | C1CN(C[C@@H]2[C@H]1CN2Cc1cccnc1)C(c1cc2ccccc2[nH]1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.4871 |
| logD: | 1.2991 |
| logSw: | -2.8521 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.868 |
| InChI Key: | RUDYFILQYLLRIA-PXNSSMCTSA-N |