5-[(azepan-1-yl)acetyl]-9-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-[(azepan-1-yl)acetyl]-9-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
5-[(azepan-1-yl)acetyl]-9-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S747-0737 |
| Compound Name: | 5-[(azepan-1-yl)acetyl]-9-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 454.57 |
| Molecular Formula: | C24 H34 N6 O3 |
| Smiles: | C1CCCN(CC1)CC(N1CCCC(CCNC(CC1)=O)c1nc(c2cccnc2)no1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1047 |
| logD: | 0.466 |
| logSw: | -1.359 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.973 |
| InChI Key: | XBAKMCFVBGQRNH-IBGZPJMESA-N |