Nombre: 1-(4-methylphenylsulfonyl)-5-bromoindole-3-carboxaldehyde
SMILES:
Cc1ccc(S(=O)(=O)n2cc(C=O)c3cc(Br)ccc32)cc1Molecular Processing
Molecular formula
C16H12BrNO3S
Molecular weight
378.25
Exact mass
376.9721
XLogP
3.76
TPSA
56.14
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.062
Molar refractivity
88.79
Supplementary Information
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