11-imino-2-phenylhexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile
Chemical Structure Depiction of
11-imino-2-phenylhexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile
11-imino-2-phenylhexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile
Compound characteristics
| Compound ID: | 8019-9802 |
| Compound Name: | 11-imino-2-phenylhexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile |
| Molecular Weight: | 346.39 |
| Molecular Formula: | C20 H18 N4 O2 |
| Smiles: | C1CCC2C3(C#N)C(=N)OC2(CC1)OC(c1ccccc1)C3(C#N)C#N |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2859 |
| logD: | 3.2859 |
| logSw: | -3.4889 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.345 |
| InChI Key: | DSWYUGSSEJEZIF-UHFFFAOYSA-N |