SMILES:
COc1ccc(-c2cc(C(F)(F)F)cc3[nH]ncc23)c(C)n1Molecular Processing
Molecular formula
C15H12F3N3O
Molecular weight
307.28
Exact mass
307.0932
XLogP
3.96
TPSA
50.8
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
75.62
Supplementary Information
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