4-(2-amino-3-cyano-5-oxo-4H,5H-pyrano[3,2-c][1]benzopyran-4-yl)phenyl furan-2-carboxylate
Chemical Structure Depiction of
4-(2-amino-3-cyano-5-oxo-4H,5H-pyrano[3,2-c][1]benzopyran-4-yl)phenyl furan-2-carboxylate
4-(2-amino-3-cyano-5-oxo-4H,5H-pyrano[3,2-c][1]benzopyran-4-yl)phenyl furan-2-carboxylate
Compound characteristics
| Compound ID: | K638-0119 |
| Compound Name: | 4-(2-amino-3-cyano-5-oxo-4H,5H-pyrano[3,2-c][1]benzopyran-4-yl)phenyl furan-2-carboxylate |
| Molecular Weight: | 426.38 |
| Molecular Formula: | C24 H14 N2 O6 |
| Smiles: | C(C1C(C2=C(c3ccccc3OC2=O)OC=1N)c1ccc(cc1)OC(c1ccco1)=O)#N |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6791 |
| logD: | 2.6791 |
| logSw: | -3.5101 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.656 |
| InChI Key: | DEEWXEZECCQNGB-LJQANCHMSA-N |