Chemical ID: 4323213

CC1=NN(C(=O)C1=Cc2cc(ccc2OC)OC)c3ccc(cc3)C(=O)O
Chemical ID:
4323213
Name [?]:
4-[4-[(2,5-dimethoxyphenyl)methylene]-3-methyl-5-oxo-pyrazol-1-yl]benzoic acid
SMILES [?]:
CC1=NN(C(=O)C1=Cc2cc(ccc2OC)OC)c3ccc(cc3)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H18N2O5
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:9.26602
Area:574.017
Solvation:-5.0844
Coulombic:-58.1333
Bond Count [?]
All:29
Single:19
Double:10
Rotors:5
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:366.367
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:3.21
LogP (Chemaxon):3.11

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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