SMILES:
FC(F)(F)c1cc(Cl)nc(-c2cnccn2)n1Molecular Processing
Molecular formula
C9H4ClF3N4
Molecular weight
260.61
Exact mass
260.0077
XLogP
2.61
TPSA
51.56
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
53.07
Supplementary Information
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