2-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
2-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K978-0374 |
| Compound Name: | 2-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione |
| Molecular Weight: | 380.45 |
| Molecular Formula: | C21 H24 N4 O3 |
| Smiles: | C(CN1C(C2C3CC(C=C3)C2C1=O)=O)C(N1CCN(CC1)c1ccccn1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.9335 |
| logD: | 0.9246 |
| logSw: | -1.3828 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.479 |
| InChI Key: | BEUKPIYAUUAVPL-UHFFFAOYSA-N |