2-(3,5-dimethyl-1H-pyrazol-1-yl)-1-{rel-(1R,5S)-3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-8-azabicyclo[3.2.1]octan-8-yl}ethan-1-one
Chemical Structure Depiction of
2-(3,5-dimethyl-1H-pyrazol-1-yl)-1-{rel-(1R,5S)-3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-8-azabicyclo[3.2.1]octan-8-yl}ethan-1-one
2-(3,5-dimethyl-1H-pyrazol-1-yl)-1-{rel-(1R,5S)-3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-8-azabicyclo[3.2.1]octan-8-yl}ethan-1-one
Compound characteristics
| Compound ID: | S253-1096 |
| Compound Name: | 2-(3,5-dimethyl-1H-pyrazol-1-yl)-1-{rel-(1R,5S)-3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-8-azabicyclo[3.2.1]octan-8-yl}ethan-1-one |
| Molecular Weight: | 392.46 |
| Molecular Formula: | C21 H24 N6 O2 |
| Smiles: | Cc1cc(C)n(CC(N2[C@H]3CC[C@@H]2C[C@H](C3)c2nc(c3ccncc3)no2)=O)n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.2547 |
| logD: | 1.2547 |
| logSw: | -1.491 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 70.072 |
| InChI Key: | ULOCODOCEGHHFH-BCDXTJNWSA-N |