Chemical ID: 4903614

COc1cc(c(cc1OC)OC)C=C2C(=O)c3ccc(cc3O2)OC(=O)c4ccc(cc4)Br
Chemical ID:
4903614
Name [?]:
[3-oxo-2-[(2,4,5-trimethoxyphenyl)methylene]benzofuran-6-yl] 4-bromobenzoate
SMILES [?]:
COc1cc(c(cc1OC)OC)C=C2C(=O)c3ccc(cc3O2)OC(=O)c4ccc(cc4)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H19BrO7
All Atoms:33
Heavy Atoms:33
Chiral Atoms:0
ZAP Information [?]
Total:9.84409
Area:682.458
Solvation:-7.21737
Coulombic:-58.3154
Bond Count [?]
All:36
Single:24
Double:12
Rotors:7
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:511.318
H-Bond Donors:0
H-Bond Acceptors:7
XLogP:5.41
LogP (Chemaxon):4.59

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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