SMILES:
COC(=O)N(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Cc1cc(F)ccc1BrMolecular Processing
Molecular formula
C18H13BrF7NO2
Molecular weight
488.2
Exact mass
487.0018
XLogP
6.39
TPSA
29.54
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
29
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
0.278
Molar refractivity
92.2
Supplementary Information
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