SMILES:
Fc1ccc2c(c1)C(c1ccc(C(F)(F)F)cc1)=NCC2Molecular Processing
Molecular formula
C16H11F4N
Molecular weight
293.26
Exact mass
293.0828
XLogP
4.24
TPSA
12.36
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
72.05
Supplementary Information
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