SMILES:
CN1CCC(C(=O)c2cccc(NC(=O)c3c(F)cc(F)cc3F)n2)CC1.ClMolecular Processing
Molecular formula
C19H19ClF3N3O2
Molecular weight
413.83
Exact mass
413.1118
XLogP
3.7
TPSA
62.3
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
2
Fraction Csp3
0.316
Molar refractivity
100.31
Supplementary Information
Details werden geladen…
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