SMILES:
O=S(=O)(c1ccc(Cl)cc1)c1cnc2cc(Cl)ccc2c1BrMolecular Processing
Molecular formula
C15H8BrCl2NO2S
Molecular weight
417.11
Exact mass
414.8836
XLogP
5.14
TPSA
47.03
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0
Molar refractivity
91.36
Supplementary Information
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