COc1ccccc1NS(=O)(=O)c1ccc(Br)cc1
Name: N-(2-methoxyphenyl)-4-bromo-benzenesulfonamide
SMILES: COc1ccccc1NS(=O)(=O)c1ccc(Br)cc1

Molecular Processing

Molecular formula
C13H12BrNO3S
Molecular weight
342.21
Exact mass
340.9721
XLogP
3.26
TPSA
55.4
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
77.94

Supplementary Information

Details werden geladen…

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