11-imino-2-(pyridin-3-yl)hexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile
Chemical Structure Depiction of
11-imino-2-(pyridin-3-yl)hexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile
11-imino-2-(pyridin-3-yl)hexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile
Compound characteristics
| Compound ID: | 8020-7968 |
| Compound Name: | 11-imino-2-(pyridin-3-yl)hexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile |
| Molecular Weight: | 347.37 |
| Molecular Formula: | C19 H17 N5 O2 |
| Smiles: | C1CCC2C3(C#N)C(=N)OC2(CC1)OC(c1cccnc1)C3(C#N)C#N |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.0783 |
| logD: | 2.0783 |
| logSw: | -1.8802 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.863 |
| InChI Key: | PWRHDKABVDIAPR-UHFFFAOYSA-N |