SMILES:
O=C(O)c1cn(-c2ccc(F)cc2F)c2cc(Cl)c(F)c(Cl)c2c1=OMolecular Processing
Molecular formula
C16H6Cl2F3NO3
Molecular weight
388.13
Exact mass
386.9677
XLogP
4.41
TPSA
59.3
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0
Molar refractivity
86.4
Supplementary Information
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