SMILES:
O=C1N(Cc2ccc(OC(F)(F)F)cc2)c2ccccc2C12COc1cc3c(cc12)OCO3Molecular Processing
Molecular formula
C24H16F3NO5
Molecular weight
455.39
Exact mass
455.0981
XLogP
4.54
TPSA
57.23
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
33
Rings
6
Aromatic rings
3
Saturated rings
0
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.208
Molar refractivity
109.6
Supplementary Information
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