SMILES:
COC(=O)C(Br)Cc1ccc(OC)c(C(=O)NCc2ccc(C(F)(F)F)cc2)c1Molecular Processing
Molecular formula
C20H19BrF3NO4
Molecular weight
474.27
Exact mass
473.045
XLogP
4.12
TPSA
64.63
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
29
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
104.04
Supplementary Information
Récupération des détails…
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