SMILES:
CCOC(=O)c1cnnc(-c2cccc(C(F)(F)F)c2)c1Molecular Processing
Molecular formula
C14H11F3N2O2
Molecular weight
296.25
Exact mass
296.0773
XLogP
3.34
TPSA
52.08
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
68.43
Supplementary Information
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