SMILES:
CC1(Cc2ccc(OC(F)(F)F)cc2)C(=O)N(c2cc(Cl)cc(Cl)c2)c2nccn21Molecular Processing
Molecular formula
C20H14Cl2F3N3O2
Molecular weight
456.25
Exact mass
455.0415
XLogP
5.72
TPSA
47.36
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
106.31
Supplementary Information
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