2-amino-4-(3-fluoro-4-phenoxyphenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(3-fluoro-4-phenoxyphenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
2-amino-4-(3-fluoro-4-phenoxyphenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Compound characteristics
Compound ID: | 7954-5081 |
Compound Name: | 2-amino-4-(3-fluoro-4-phenoxyphenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile |
Molecular Weight: | 406.37 |
Molecular Formula: | C22 H15 F N2 O5 |
Smiles: | C(C1=CC(C2=C(C(C(C#N)=C(N)O2)c2ccc(c(c2)F)Oc2ccccc2)O1)=O)O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.6115 |
logD: | 2.6115 |
logSw: | -3.3036 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 93.544 |
InChI Key: | TUUDTZYKFIWRRQ-IBGZPJMESA-N |