Name: 5-fluoro-2-iodo-4-trifluoromethyl-1,3-benzothiazole
SMILES:
Fc1ccc2sc(I)nc2c1C(F)(F)FMolecular Processing
Molecular formula
C8H2F4INS
Molecular weight
347.07
Exact mass
346.8889
XLogP
4.06
TPSA
12.89
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
57.3
Supplementary Information
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