SMILES:
O=C(C=C1SCCN1Cc1ccc(Cl)nc1)C(F)(F)FMolecular Processing
Molecular formula
C12H10ClF3N2OS
Molecular weight
322.74
Exact mass
322.0154
XLogP
3.26
TPSA
33.2
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20
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
0.333
Molar refractivity
71.26
Supplementary Information
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