SMILES:
Cc1cc(Nc2nccc(C(F)(F)F)n2)cc(-c2cnc(C3CCS(=O)(=O)CC3)s2)c1Molecular Processing
Molecular formula
C20H19F3N4O2S2
Molecular weight
468.53
Exact mass
468.0902
XLogP
4.96
TPSA
84.84
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
31
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
0.35
Molar refractivity
113.23
Supplementary Information
Obteniendo detalles…
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