4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-{3-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}butan-1-one
Chemical Structure Depiction of
4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-{3-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}butan-1-one
4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-{3-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | S428-1226 |
| Compound Name: | 4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-{3-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}butan-1-one |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C24 H29 N5 O4 |
| Smiles: | Cc1ccc(cc1)c1nc(CCCC(N2CCC(C2)c2nc(C3CCOCC3)no2)=O)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2436 |
| logD: | 4.2436 |
| logSw: | -4.1847 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 87.508 |
| InChI Key: | KPCDNWOKYDHFAI-LJQANCHMSA-N |