3,3,4-tricyano-3,4,5,6,7,8-hexahydro-2H-1-benzopyran-4-carboxamide
Chemical Structure Depiction of
3,3,4-tricyano-3,4,5,6,7,8-hexahydro-2H-1-benzopyran-4-carboxamide
3,3,4-tricyano-3,4,5,6,7,8-hexahydro-2H-1-benzopyran-4-carboxamide
Compound characteristics
| Compound ID: | 8020-3180 |
| Compound Name: | 3,3,4-tricyano-3,4,5,6,7,8-hexahydro-2H-1-benzopyran-4-carboxamide |
| Molecular Weight: | 256.26 |
| Molecular Formula: | C13 H12 N4 O2 |
| Smiles: | C1CCC2=C(C1)C(C#N)(C(N)=O)C(CO2)(C#N)C#N |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5641 |
| logD: | 0.5641 |
| logSw: | -0.3847 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.896 |
| InChI Key: | XCHXXPZJIMVTGO-ZDUSSCGKSA-N |