SMILES:
Nc1ccc(-c2noc(=O)[nH]2)cc1OC(F)(F)FMolecular Processing
Molecular formula
C9H6F3N3O3
Molecular weight
261.16
Exact mass
261.0361
XLogP
1.51
TPSA
94.14
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
53.66
Supplementary Information
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