N-(2,5-dimethoxyphenyl)-2-[rel-(4R,7S)-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]acetamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-2-[rel-(4R,7S)-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]acetamide
N-(2,5-dimethoxyphenyl)-2-[rel-(4R,7S)-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]acetamide
Compound characteristics
| Compound ID: | K978-0095 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-2-[rel-(4R,7S)-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]acetamide |
| Molecular Weight: | 356.38 |
| Molecular Formula: | C19 H20 N2 O5 |
| Smiles: | COc1ccc(c(c1)NC(CN1C(C2C(C1=O)[C@@H]1C[C@H]2C=C1)=O)=O)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.1284 |
| logD: | 1.1277 |
| logSw: | -2.2557 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.962 |
| InChI Key: | GLZZACZYRVQYSE-UHFFFAOYSA-N |