SMILES:
CC(C(=O)Nc1ccc(C(=O)O)cc1)n1cc(Cl)c(-c2cc(Cl)ccc2C(F)F)cc1=OMolecular Processing
Molecular formula
C22H16Cl2F2N2O4
Molecular weight
481.28
Exact mass
480.0455
XLogP
5.66
TPSA
88.4
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
32
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.136
Molar refractivity
117.86
Supplementary Information
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