N-(2,5-dimethoxyphenyl)-4-[rel-(3aR,7aS)-5-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl]benzamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-4-[rel-(3aR,7aS)-5-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl]benzamide
N-(2,5-dimethoxyphenyl)-4-[rel-(3aR,7aS)-5-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl]benzamide
Compound characteristics
| Compound ID: | 4117-0190 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-4-[rel-(3aR,7aS)-5-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl]benzamide |
| Molecular Weight: | 420.46 |
| Molecular Formula: | C24 H24 N2 O5 |
| Smiles: | CC1C[C@@H]2C(N(C([C@@H]2CC=1)=O)c1ccc(cc1)C(Nc1cc(ccc1OC)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.2586 |
| logD: | 3.2312 |
| logSw: | -3.4493 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.64 |
| InChI Key: | KNVNFLGDHMPQIF-OALUTQOASA-N |