5-(3-methylbutanoyl)-9-(3-phenyl-1,2,4-oxadiazol-5-yl)-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-(3-methylbutanoyl)-9-(3-phenyl-1,2,4-oxadiazol-5-yl)-1,5-diazacycloundecan-2-one
5-(3-methylbutanoyl)-9-(3-phenyl-1,2,4-oxadiazol-5-yl)-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S747-0321 |
| Compound Name: | 5-(3-methylbutanoyl)-9-(3-phenyl-1,2,4-oxadiazol-5-yl)-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 398.5 |
| Molecular Formula: | C22 H30 N4 O3 |
| Smiles: | CC(C)CC(N1CCCC(CCNC(CC1)=O)c1nc(c2ccccc2)no1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8554 |
| logD: | 2.8554 |
| logSw: | -3.2356 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.391 |
| InChI Key: | QLQJVCYVTJXKEH-SFHVURJKSA-N |