2-[rel-(4R,7S)-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl]-N-(4-methylphenyl)acetamide
Chemical Structure Depiction of
2-[rel-(4R,7S)-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl]-N-(4-methylphenyl)acetamide
2-[rel-(4R,7S)-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl]-N-(4-methylphenyl)acetamide
Compound characteristics
| Compound ID: | 5782-5104 |
| Compound Name: | 2-[rel-(4R,7S)-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl]-N-(4-methylphenyl)acetamide |
| Molecular Weight: | 312.37 |
| Molecular Formula: | C18 H20 N2 O3 |
| Smiles: | Cc1ccc(cc1)NC(CN1C(C2C(C1=O)[C@@H]1CC[C@H]2C1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9059 |
| logD: | 1.9059 |
| logSw: | -2.534 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.485 |
| InChI Key: | BFHNTYNTVBDTCC-UHFFFAOYSA-N |