Chemical ID: 4776216

COc1ccc(c(c1)OC)NC(=O)C=CC(=O)O
Chemical ID:
4776216
Name [?]:
4-(2,4-dimethoxyphenyl)amino-4-oxo-but-2-enoic acid
SMILES [?]:
COc1ccc(c(c1)OC)NC(=O)C=CC(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H13NO5
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:5.32779
Area:431.584
Solvation:-5.4618
Coulombic:-60.3666
Bond Count [?]
All:18
Single:12
Double:6
Rotors:6
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:251.235
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:0.77
LogP (Chemaxon):1.08

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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