SMILES:
O=S(=O)(c1ccccc1)n1c(CBr)cc2nc(Cl)ccc21Molecular Processing
Molecular formula
C14H10BrClN2O2S
Molecular weight
385.67
Exact mass
383.9335
XLogP
3.82
TPSA
51.96
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
21
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
0.071
Molar refractivity
86.4
Supplementary Information
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