Chemical ID: 4705773

c1cc(ccc1c2cc(c(c(=S)[nH]2)C#N)C(F)(F)F)F
Chemical ID:
4705773
Name [?]:
6-(4-fluorophenyl)-2-thioxo-4-(trifluoromethyl)-1H-pyridine-3-carbonitrile
SMILES [?]:
c1cc(ccc1c2cc(c(c(=S)[nH]2)C#N)C(F)(F)F)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H6F4N2S
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:7.4784
Area:435.221
Solvation:-3.40213
Coulombic:-36.1777
Bond Count [?]
All:21
Single:14
Double:6
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:298.26
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.38
LogP (Chemaxon):3.56

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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