Chemical ID: 4723959

Cc1c(c2nc(cc(n2n1)C(F)(F)F)c3ccco3)Br
Chemical ID:
4723959
Name [?]:
9-bromo-3-(2-furyl)-8-methyl-5-(trifluoromethyl)-2,6,7-triazabicyclo[4.3.0]nona-2,4,7,9-tetraene
SMILES [?]:
Cc1c(c2nc(cc(n2n1)C(F)(F)F)c3ccco3)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H7BrF3N3O
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.20044
Area:436.554
Solvation:-2.71342
Coulombic:-36.9485
Bond Count [?]
All:22
Single:16
Double:6
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:346.103
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:2.66
LogP (Chemaxon):3.56

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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