SMILES:
CCS(=O)(=O)Cc1cncc(Br)c1Molecular Processing
Molecular formula
C8H10BrNO2S
Molecular weight
264.14
Exact mass
262.9616
XLogP
1.78
TPSA
47.03
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
55.1
Supplementary Information
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