5-(3-methylbenzoyl)-9-[3-(pyrazin-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-(3-methylbenzoyl)-9-[3-(pyrazin-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
5-(3-methylbenzoyl)-9-[3-(pyrazin-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S747-1213 |
| Compound Name: | 5-(3-methylbenzoyl)-9-[3-(pyrazin-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 434.5 |
| Molecular Formula: | C23 H26 N6 O3 |
| Smiles: | Cc1cccc(c1)C(N1CCCC(CCNC(CC1)=O)c1nc(c2cnccn2)no1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1466 |
| logD: | 1.1464 |
| logSw: | -1.5657 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.213 |
| InChI Key: | VQQLUPCGVHJEMI-KRWDZBQOSA-N |