SMILES:
COC(=O)c1c(-c2ccc(F)cc2)oc2ccc(Br)nc12Molecular Processing
Molecular formula
C15H9BrFNO3
Molecular weight
350.14
Exact mass
348.975
XLogP
4.18
TPSA
52.33
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
21
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.067
Molar refractivity
78.44
Supplementary Information
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