Chemical ID: 4573923

COc1cc(cc(c1OC)OC)C=C2C(=O)c3ccc(cc3O2)OC(=O)C4CC4
Chemical ID:
4573923
Name [?]:
[3-oxo-2-[(3,4,5-trimethoxyphenyl)methylene]benzofuran-6-yl] cyclopropanecarboxylate
SMILES [?]:
COc1cc(cc(c1OC)OC)C=C2C(=O)c3ccc(cc3O2)OC(=O)C4CC4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H20O7
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:7.97006
Area:609.368
Solvation:-7.26414
Coulombic:-56.5628
Bond Count [?]
All:32
Single:23
Double:9
Rotors:7
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:396.39
H-Bond Donors:0
H-Bond Acceptors:7
XLogP:2.97
LogP (Chemaxon):2.76

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