N-benzyl-4-oxo-8-[3-(pyrazin-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecane-1-carboxamide
Chemical Structure Depiction of
N-benzyl-4-oxo-8-[3-(pyrazin-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecane-1-carboxamide
N-benzyl-4-oxo-8-[3-(pyrazin-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecane-1-carboxamide
Compound characteristics
| Compound ID: | S747-1407 |
| Compound Name: | N-benzyl-4-oxo-8-[3-(pyrazin-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecane-1-carboxamide |
| Molecular Weight: | 449.51 |
| Molecular Formula: | C23 H27 N7 O3 |
| Smiles: | C1CC(CCNC(CCN(C1)C(NCc1ccccc1)=O)=O)c1nc(c2cnccn2)no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8474 |
| logD: | 0.8472 |
| logSw: | -1.189 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.356 |
| InChI Key: | AGMMEIUSHHUITJ-SFHVURJKSA-N |