rel-(4R,7S)-2-(pyridin-2-yl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Chemical Structure Depiction of
rel-(4R,7S)-2-(pyridin-2-yl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
rel-(4R,7S)-2-(pyridin-2-yl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 5135-0056 |
| Compound Name: | rel-(4R,7S)-2-(pyridin-2-yl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione |
| Molecular Weight: | 240.26 |
| Molecular Formula: | C14 H12 N2 O2 |
| Smiles: | C1[C@H]2C=C[C@@H]1C1C2C(N(C1=O)c1ccccn1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.067 |
| logD: | 1.067 |
| logSw: | -1.5443 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.236 |
| InChI Key: | VOMLWUQRCXRNBP-CRRMYELQSA-N |