SMILES:
CCCOC(=O)COc1cc(-c2ncc(C(F)(F)F)n(C)c2=O)c(F)cc1ClMolecular Processing
Molecular formula
C17H15ClF4N2O4
Molecular weight
422.76
Exact mass
422.0656
XLogP
3.59
TPSA
70.42
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
28
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.353
Molar refractivity
91.63
Supplementary Information
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