SMILES:
Cc1ccc(S(=O)(=O)C(CN)c2cccc(Br)c2)cc1Molecular Processing
Molecular formula
C15H16BrNO2S
Molecular weight
354.27
Exact mass
353.0085
XLogP
3.23
TPSA
60.16
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
84.3
Supplementary Information
Obteniendo detalles…
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