SMILES:
N#Cc1ccc(-n2c(=O)cc(C(F)(F)F)[nH]c2=O)cc1[N+](=O)[O-]Molecular Processing
Molecular formula
C12H5F3N4O4
Molecular weight
326.19
Exact mass
326.0263
XLogP
1.32
TPSA
121.79
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.083
Molar refractivity
69.03
Supplementary Information
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