SMILES:
O=C(NCCN1CCOCC1)c1ccncc1Nc1ccc(I)cc1FMolecular Processing
Molecular formula
C18H20FIN4O2
Molecular weight
470.29
Exact mass
470.0615
XLogP
2.63
TPSA
66.49
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
106.23
Supplementary Information
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