Name: trifluoro-methanesulfonic acid 6-methoxy-1-[4-(2-piperidin-1-yl-ethoxy)-benzoyl]-naphthalen-2-yl ester
SMILES:
COc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(OS(=O)(=O)C(F)(F)F)ccc2c1Molecular Processing
Molecular formula
C26H26F3NO6S
Molecular weight
537.56
Exact mass
537.1433
XLogP
5.17
TPSA
82.14
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
9
Heavy atoms
37
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.346
Molar refractivity
131.76
Supplementary Information
Details werden geladen…
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