SMILES:
Cc1[nH]c2ccc(OCCI)cc2c1C(=O)OCc1ccccc1Molecular Processing
Molecular formula
C19H18INO3
Molecular weight
435.26
Exact mass
435.0331
XLogP
4.65
TPSA
51.32
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
24
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.211
Molar refractivity
102.98
Supplementary Information
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