3-(2H-1,3-benzodioxol-5-yl)-1-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}prop-2-en-1-one
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-1-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}prop-2-en-1-one
3-(2H-1,3-benzodioxol-5-yl)-1-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}prop-2-en-1-one
Compound characteristics
| Compound ID: | L948-1450 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-1-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}prop-2-en-1-one |
| Molecular Weight: | 403.44 |
| Molecular Formula: | C23 H21 N3 O4 |
| Smiles: | Cc1cccc(c1)c1nc(C2CCCN2C(/C=C/c2ccc3c(c2)OCO3)=O)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8761 |
| logD: | 4.8761 |
| logSw: | -4.7209 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.94 |
| InChI Key: | GKXUNXZRDGHKGN-SFHVURJKSA-N |