Chemical ID: 5227694

COc1cc(c(cc1C(=O)C=Cc2ccncc2)C(=O)O)OC
Chemical ID:
5227694
Name [?]:
2,4-dimethoxy-5-[3-(4-pyridyl)prop-2-enoyl]benzoic acid
SMILES [?]:
COc1cc(c(cc1C(=O)C=Cc2ccncc2)C(=O)O)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H15NO5
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:4.89007
Area:499.727
Solvation:-7.6031
Coulombic:-50.5898
Bond Count [?]
All:24
Single:15
Double:9
Rotors:6
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:313.305
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.04
LogP (Chemaxon):0.21

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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