Chemical ID: 3998994

COc1cccc(c1)c2c(cn(n2)c3ccc(cc3)F)C=O
Chemical ID:
3998994
Name [?]:
1-(4-fluorophenyl)-3-(3-methoxyphenyl)-pyrazole-4-carbaldehyde
SMILES [?]:
COc1cccc(c1)c2c(cn(n2)c3ccc(cc3)F)C=O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H13FN2O2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:7.05661
Area:489.649
Solvation:-5.18461
Coulombic:-22.7066
Bond Count [?]
All:24
Single:15
Double:9
Rotors:4
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:296.296
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:3.71
LogP (Chemaxon):3.65

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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