N-(4-bromo-2-methylphenyl)-3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)propanamide
Chemical Structure Depiction of
N-(4-bromo-2-methylphenyl)-3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)propanamide
N-(4-bromo-2-methylphenyl)-3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)propanamide
Compound characteristics
| Compound ID: | K978-0414 |
| Compound Name: | N-(4-bromo-2-methylphenyl)-3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)propanamide |
| Molecular Weight: | 403.27 |
| Molecular Formula: | C19 H19 Br N2 O3 |
| Smiles: | Cc1cc(ccc1NC(CCN1C(C2C3CC(C=C3)C2C1=O)=O)=O)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3025 |
| logD: | 2.3017 |
| logSw: | -2.8756 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.766 |
| InChI Key: | PFIWWYITADOZAM-UHFFFAOYSA-N |