SMILES:
CC1(C(=O)Nc2ccc(OC(F)F)c(Br)c2)CC1Molecular Processing
Molecular formula
C12H12BrF2NO2
Molecular weight
320.13
Exact mass
319.0019
XLogP
3.79
TPSA
38.33
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
66.74
Supplementary Information
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