3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-ethanoisoindol-2-yl)-N-(3-fluoro-4-methylphenyl)propanamide
Chemical Structure Depiction of
3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-ethanoisoindol-2-yl)-N-(3-fluoro-4-methylphenyl)propanamide
3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-ethanoisoindol-2-yl)-N-(3-fluoro-4-methylphenyl)propanamide
Compound characteristics
| Compound ID: | C082-0552 |
| Compound Name: | 3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-ethanoisoindol-2-yl)-N-(3-fluoro-4-methylphenyl)propanamide |
| Molecular Weight: | 356.4 |
| Molecular Formula: | C20 H21 F N2 O3 |
| Smiles: | Cc1ccc(cc1F)NC(CCN1C(C2C3CCC(C=C3)C2C1=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.5007 |
| logD: | 2.4999 |
| logSw: | -2.8314 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.732 |
| InChI Key: | JWPIMWCGUDFSOD-UHFFFAOYSA-N |