SMILES:
CCOC(=O)c1cc(C)n(-c2cccc(I)c2)c1-c1ccccc1Molecular Processing
Molecular formula
C20H18INO2
Molecular weight
431.27
Exact mass
431.0382
XLogP
5.23
TPSA
31.23
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
24
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.15
Molar refractivity
104.62
Supplementary Information
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