Chemical ID: 4403661

Cc1ccc(c(c1)C(=O)C=Cc2ccccc2OC)OC(=O)c3ccccc3Br
Chemical ID:
4403661
Name [?]:
[2-[3-(2-methoxyphenyl)prop-2-enoyl]-4-methyl-phenyl] 2-bromobenzoate
SMILES [?]:
Cc1ccc(c(c1)C(=O)C=Cc2ccccc2OC)OC(=O)c3ccccc3Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H19BrO4
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:10.7458
Area:592.146
Solvation:-4.05787
Coulombic:-38.1025
Bond Count [?]
All:31
Single:19
Double:12
Rotors:7
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:451.309
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:6.5
LogP (Chemaxon):6.25

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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