Chemical ID: 4574661

COc1cccc(c1OC)C=C2C(=O)c3ccc(cc3O2)OC(=O)c4ccccc4
Chemical ID:
4574661
Name [?]:
[2-[(2,3-dimethoxyphenyl)methylene]-3-oxo-benzofuran-6-yl] benzoate
SMILES [?]:
COc1cccc(c1OC)C=C2C(=O)c3ccc(cc3O2)OC(=O)c4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H18O6
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:10.2052
Area:619.072
Solvation:-5.2716
Coulombic:-53.8163
Bond Count [?]
All:33
Single:21
Double:12
Rotors:6
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:402.396
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:4.7
LogP (Chemaxon):4.06

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue