CCOc1ccc(Oc2ccc3c(c2)CCC(c2cc(F)ccc2F)O3)c([N+](=O)[O-])c1
SMILES: CCOc1ccc(Oc2ccc3c(c2)CCC(c2cc(F)ccc2F)O3)c([N+](=O)[O-])c1

Molecular Processing

Molecular formula
C23H19F2NO5
Molecular weight
427.4
Exact mass
427.1231
XLogP
6.13
TPSA
70.83
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.217
Molar refractivity
108.83

Supplementary Information

Details werden geladen…

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