2-amino-4-[3-(benzyloxy)phenyl]-5-oxo-4H,5H-pyrano[3,2-c][1]benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-[3-(benzyloxy)phenyl]-5-oxo-4H,5H-pyrano[3,2-c][1]benzopyran-3-carbonitrile
2-amino-4-[3-(benzyloxy)phenyl]-5-oxo-4H,5H-pyrano[3,2-c][1]benzopyran-3-carbonitrile
Compound characteristics
Compound ID: | 3132-0287 |
Compound Name: | 2-amino-4-[3-(benzyloxy)phenyl]-5-oxo-4H,5H-pyrano[3,2-c][1]benzopyran-3-carbonitrile |
Molecular Weight: | 422.44 |
Molecular Formula: | C26 H18 N2 O4 |
Smiles: | C(c1ccccc1)Oc1cccc(c1)C1C(C#N)=C(N)OC2=C1C(=O)Oc1ccccc12 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.9019 |
logD: | 3.9019 |
logSw: | -4.4225 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 74.927 |
InChI Key: | WXVFYUZGARDKIL-JOCHJYFZSA-N |