SMILES:
CCOC(=O)C(C#N)c1cccc(Oc2ccccc2F)c1OCMolecular Processing
Molecular formula
C18H16FNO4
Molecular weight
329.33
Exact mass
329.1063
XLogP
3.8
TPSA
68.55
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
84.46
Supplementary Information
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