Chemical ID: 5579014

Cn1c2ccccc2c(c(c1=O)C3=NNC(=O)C3=Cc4ccco4)O
Chemical ID:
5579014
Name [?]:
3-[4-(2-furylmethylene)-5-oxo-1H-pyrazol-3-yl]-4-hydroxy-1-methyl-quinolin-2-one
SMILES [?]:
Cn1c2ccccc2c(c(c1=O)C3=NNC(=O)C3=Cc4ccco4)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H13N3O4
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:7.42675
Area:470.583
Solvation:-4.33784
Coulombic:-59.3255
Bond Count [?]
All:28
Single:18
Double:10
Rotors:2
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:335.314
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:1.92
LogP (Chemaxon):2.28

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Experimental Annotations

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Descriptor Annotations

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