SMILES:
COC(=O)c1cc2c(Cl)cc(F)c(-n3c(=O)cc(C(F)(F)F)n(C)c3=O)c2o1Molecular Processing
Molecular formula
C16H9ClF4N2O5
Molecular weight
420.7
Exact mass
420.0136
XLogP
2.88
TPSA
83.44
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
28
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
88.36
Supplementary Information
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