SMILES:
O=C(N1CCC(NCCSc2cccs2)CC1)C(F)(F)FMolecular Processing
Molecular formula
C13H17F3N2OS2
Molecular weight
338.42
Exact mass
338.0734
XLogP
2.98
TPSA
32.34
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.615
Molar refractivity
78.7
Supplementary Information
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