2-(furan-2-yl)-10-iminotetrahydro-8a,4-(epoxymethano)-1-benzopyran-3,3,4(2H,4aH)-tricarbonitrile
Chemical Structure Depiction of
2-(furan-2-yl)-10-iminotetrahydro-8a,4-(epoxymethano)-1-benzopyran-3,3,4(2H,4aH)-tricarbonitrile
2-(furan-2-yl)-10-iminotetrahydro-8a,4-(epoxymethano)-1-benzopyran-3,3,4(2H,4aH)-tricarbonitrile
Compound characteristics
| Compound ID: | 8014-2365 |
| Compound Name: | 2-(furan-2-yl)-10-iminotetrahydro-8a,4-(epoxymethano)-1-benzopyran-3,3,4(2H,4aH)-tricarbonitrile |
| Molecular Weight: | 322.32 |
| Molecular Formula: | C17 H14 N4 O3 |
| Smiles: | C1CCC23C(C1)C(C#N)(C(=N)O3)C(C#N)(C#N)C(c1ccco1)O2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9471 |
| logD: | 1.9471 |
| logSw: | -1.9843 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.593 |
| InChI Key: | BVDKVZYFFOFXQL-UHFFFAOYSA-N |