SMILES:
COc1nc(C(F)(F)F)cc(=O)n1-c1cc(O)c(Cl)cc1FMolecular Processing
Molecular formula
C12H7ClF4N2O3
Molecular weight
338.64
Exact mass
338.0081
XLogP
2.76
TPSA
64.35
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
68.02
Supplementary Information
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