(4-chloro-2-methoxyphenyl){rel-(1R,5S)-3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-8-azabicyclo[3.2.1]octan-8-yl}methanone
Chemical Structure Depiction of
(4-chloro-2-methoxyphenyl){rel-(1R,5S)-3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-8-azabicyclo[3.2.1]octan-8-yl}methanone
(4-chloro-2-methoxyphenyl){rel-(1R,5S)-3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-8-azabicyclo[3.2.1]octan-8-yl}methanone
Compound characteristics
| Compound ID: | S253-1040 |
| Compound Name: | (4-chloro-2-methoxyphenyl){rel-(1R,5S)-3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-8-azabicyclo[3.2.1]octan-8-yl}methanone |
| Molecular Weight: | 424.89 |
| Molecular Formula: | C22 H21 Cl N4 O3 |
| Smiles: | COc1cc(ccc1C(N1[C@H]2CC[C@@H]1C[C@H](C2)c1nc(c2ccncc2)no1)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.8219 |
| logD: | 3.8218 |
| logSw: | -4.3035 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.223 |
| InChI Key: | WUYDTDMDTSGUGI-ACHSLPGTSA-N |