SMILES:
CC(C)OC(=O)N1CCC(Oc2cccc3c2CCN3c2ccc(I)cc2)CC1Molecular Processing
Molecular formula
C23H27IN2O3
Molecular weight
506.38
Exact mass
506.1066
XLogP
5.37
TPSA
42.01
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
29
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.435
Molar refractivity
123.15
Supplementary Information
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Involved in 7 reactions→