(3,4-dimethoxyphenyl){2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}methanone
Chemical Structure Depiction of
(3,4-dimethoxyphenyl){2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}methanone
(3,4-dimethoxyphenyl){2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}methanone
Compound characteristics
| Compound ID: | S545-0625 |
| Compound Name: | (3,4-dimethoxyphenyl){2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}methanone |
| Molecular Weight: | 408.46 |
| Molecular Formula: | C22 H24 N4 O4 |
| Smiles: | COc1ccc(cc1OC)C(N1CCCCCC1c1nc(c2cccnc2)no1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1077 |
| logD: | 2.469 |
| logSw: | -2.9283 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.096 |
| InChI Key: | CESNUXZKADQPNX-KRWDZBQOSA-N |