5-(cyclopent-3-ene-1-carbonyl)-9-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-(cyclopent-3-ene-1-carbonyl)-9-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
5-(cyclopent-3-ene-1-carbonyl)-9-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S747-0650 |
| Compound Name: | 5-(cyclopent-3-ene-1-carbonyl)-9-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 409.49 |
| Molecular Formula: | C22 H27 N5 O3 |
| Smiles: | C1CC(CCNC(CCN(C1)C(C1CC=CC1)=O)=O)c1nc(c2cccnc2)no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4146 |
| logD: | 0.7759 |
| logSw: | -1.1826 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.723 |
| InChI Key: | DDICSEKNUALHJM-INIZCTEOSA-N |