2-amino-4-{4-[(2-fluorophenyl)methoxy]phenyl}-7-(furan-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-{4-[(2-fluorophenyl)methoxy]phenyl}-7-(furan-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
2-amino-4-{4-[(2-fluorophenyl)methoxy]phenyl}-7-(furan-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 8012-0231 |
| Compound Name: | 2-amino-4-{4-[(2-fluorophenyl)methoxy]phenyl}-7-(furan-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 456.47 |
| Molecular Formula: | C27 H21 F N2 O4 |
| Smiles: | C1C(CC(C2C(C(C#N)=C(N)OC1=2)c1ccc(cc1)OCc1ccccc1F)=O)c1ccco1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.1659 |
| logD: | 4.1659 |
| logSw: | -4.5658 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.137 |
| InChI Key: | NYSGGFRKPIZDPS-UHFFFAOYSA-N |