Chemical ID: 5278023

c1ccc(c(c1)C(=O)Oc2ccc3c(c2)OC(=Cc4c(cccc4Cl)F)C3=O)Cl
Chemical ID:
5278023
Name [?]:
[2-[(2-chloro-6-fluoro-phenyl)methylene]-3-oxo-benzofuran-6-yl] 2-chlorobenzoate
SMILES [?]:
c1ccc(c(c1)C(=O)Oc2ccc3c(c2)OC(=Cc4c(cccc4Cl)F)C3=O)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H11Cl2FO4
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:11.4879
Area:619.288
Solvation:-3.99429
Coulombic:-42.2489
Bond Count [?]
All:32
Single:20
Double:12
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:429.224
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:6.54
LogP (Chemaxon):5.74

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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