2-oxo-1,2,5,6,7,8,9,10-octahydrocycloocta[b]pyridine-3,4-dicarbonitrile
Chemical Structure Depiction of
2-oxo-1,2,5,6,7,8,9,10-octahydrocycloocta[b]pyridine-3,4-dicarbonitrile
2-oxo-1,2,5,6,7,8,9,10-octahydrocycloocta[b]pyridine-3,4-dicarbonitrile
Compound characteristics
| Compound ID: | 8019-9535 |
| Compound Name: | 2-oxo-1,2,5,6,7,8,9,10-octahydrocycloocta[b]pyridine-3,4-dicarbonitrile |
| Molecular Weight: | 227.26 |
| Molecular Formula: | C13 H13 N3 O |
| Smiles: | C1CCCC2=C(CC1)C(C#N)=C(C#N)C(N2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0679 |
| logD: | 0.1435 |
| logSw: | -2.4183 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.53 |
| InChI Key: | YPBMBCSZDNLZKE-UHFFFAOYSA-N |