SMILES:
COCCOc1cc(F)c(F)c(Nc2ccc(I)cc2F)c1[N+](=O)[O-]Molecular Processing
Molecular formula
C15H12F3IN2O4
Molecular weight
468.17
Exact mass
467.9794
XLogP
4.39
TPSA
73.63
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
92.78
Supplementary Information
Details werden geladen…
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