SMILES:
Cn1ncc(F)c1-c1csc(C(=O)NC(CN)Cc2ccccc2C(F)(F)F)c1Molecular Processing
Molecular formula
C19H18F4N4OS
Molecular weight
426.44
Exact mass
426.1137
XLogP
3.61
TPSA
72.94
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
101.94
Supplementary Information
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