Chemical ID: 4572920

COc1cc(cc(c1OC)OC)C=C2C(=O)c3ccc(cc3O2)OC(=O)c4ccc(cc4)F
Chemical ID:
4572920
Name [?]:
[3-oxo-2-[(3,4,5-trimethoxyphenyl)methylene]benzofuran-6-yl] 4-fluorobenzoate
SMILES [?]:
COc1cc(cc(c1OC)OC)C=C2C(=O)c3ccc(cc3O2)OC(=O)c4ccc(cc4)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H19FO7
All Atoms:33
Heavy Atoms:33
Chiral Atoms:0
ZAP Information [?]
Total:8.30291
Area:659.956
Solvation:-8.196
Coulombic:-62.3475
Bond Count [?]
All:36
Single:24
Double:12
Rotors:7
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:450.413
H-Bond Donors:0
H-Bond Acceptors:7
XLogP:4.64
LogP (Chemaxon):3.94

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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