2-amino-4-(2-bromo-4-fluorophenyl)-5-oxo-4H,5H-pyrano[3,2-c][1]benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(2-bromo-4-fluorophenyl)-5-oxo-4H,5H-pyrano[3,2-c][1]benzopyran-3-carbonitrile
2-amino-4-(2-bromo-4-fluorophenyl)-5-oxo-4H,5H-pyrano[3,2-c][1]benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 3132-0989 |
| Compound Name: | 2-amino-4-(2-bromo-4-fluorophenyl)-5-oxo-4H,5H-pyrano[3,2-c][1]benzopyran-3-carbonitrile |
| Molecular Weight: | 413.2 |
| Molecular Formula: | C19 H10 Br F N2 O3 |
| Smiles: | C(C1C(C2=C(c3ccccc3OC2=O)OC=1N)c1ccc(cc1[Br])F)#N |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4962 |
| logD: | 3.4962 |
| logSw: | -4.0093 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.7 |
| InChI Key: | JKWJAKPQZYEFSO-OAHLLOKOSA-N |