SMILES:
CCCCC(Oc1ccc(C=O)c(Cl)c1)c1cccc(-c2ccc(C(F)(F)F)cc2)n1Molecular Processing
Molecular formula
C24H21ClF3NO2
Molecular weight
447.88
Exact mass
447.1213
XLogP
7.54
TPSA
39.19
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
31
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
114.41
Supplementary Information
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