2-ethyl-10-iminotetrahydro-8a,4-(epoxymethano)-1-benzopyran-3,3,4(2H,4aH)-tricarbonitrile
Chemical Structure Depiction of
2-ethyl-10-iminotetrahydro-8a,4-(epoxymethano)-1-benzopyran-3,3,4(2H,4aH)-tricarbonitrile
2-ethyl-10-iminotetrahydro-8a,4-(epoxymethano)-1-benzopyran-3,3,4(2H,4aH)-tricarbonitrile
Compound characteristics
| Compound ID: | 8010-3821 |
| Compound Name: | 2-ethyl-10-iminotetrahydro-8a,4-(epoxymethano)-1-benzopyran-3,3,4(2H,4aH)-tricarbonitrile |
| Molecular Weight: | 284.32 |
| Molecular Formula: | C15 H16 N4 O2 |
| Smiles: | CCC1C(C#N)(C#N)C2(C#N)C3CCCCC3(O1)OC2=N |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.0447 |
| logD: | 2.0447 |
| logSw: | -2.032 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.528 |
| InChI Key: | HBURMDUSFMIZFW-UHFFFAOYSA-N |