名称: 3-methoxy-5-nitro-3′-(6-(trifluoromethyl)pyridin-2-yl)biphenyl-4-ol
SMILES:
COc1cc(-c2cccc(-c3cccc(C(F)(F)F)n3)c2)cc([N+](=O)[O-])c1OMolecular Processing
Molecular formula
C19H13F3N2O4
Molecular weight
390.32
Exact mass
390.0827
XLogP
5.06
TPSA
85.49
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
28
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.105
Molar refractivity
94.98
Supplementary Information
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