Chemical ID: 5803064

c1cc(cc(c1)NN=C(C#N)C(=N)N2CCCCCC2)C(F)(F)F
Chemical ID:
5803064
Name [?]:
3-azepan-1-yl-3-imino-2-[3-(trifluoromethyl)phenyl]aminoimino-propanenitrile
SMILES [?]:
c1cc(cc(c1)NN=C(C#N)C(=N)N2CCCCCC2)C(F)(F)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H18F3N5
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:9.91688
Area:501.445
Solvation:-2.61923
Coulombic:-53.2308
Bond Count [?]
All:25
Single:19
Double:5
Rotors:5
Chiral:2
Rigid Segments:5
Chemical Properties
Molecular Weight:337.343
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:5.25
LogP (Chemaxon):4.9

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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