Chemical ID: 7036793

C=CCSc1c(c(cc(n1)c2ccc(cc2)F)C(F)(F)F)C#N
Chemical ID:
7036793
Name [?]:
2-allylsulfanyl-6-(4-fluorophenyl)-4-(trifluoromethyl)pyridine-3-carbonitrile
SMILES [?]:
C=CCSc1c(c(cc(n1)c2ccc(cc2)F)C(F)(F)F)C#N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H10F4N2S
All Atoms:33
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:8.98685
Area:501.84
Solvation:-3.55914
Coulombic:-32.2812
Bond Count [?]
All:24
Single:16
Double:7
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:338.324
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:4.79
LogP (Chemaxon):5.64

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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