Chemical ID: 5291871

c1ccc(c(c1)C=C2C(=O)c3ccc(cc3O2)OCc4ccc(cc4)Cl)Br
Chemical ID:
5291871
Name [?]:
2-[(2-bromophenyl)methylene]-6-[(4-chlorophenyl)methoxy]benzofuran-3-one
SMILES [?]:
c1ccc(c(c1)C=C2C(=O)c3ccc(cc3O2)OCc4ccc(cc4)Cl)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H14BrClO3
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:11.644
Area:604.436
Solvation:-3.46688
Coulombic:-28.1391
Bond Count [?]
All:30
Single:19
Double:11
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:441.701
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:6.68
LogP (Chemaxon):6.17

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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