Name: 4-{[4-(4-bromophenyl)pyrimidin-2-yl]amino}benzenesulfonamide
SMILES:
NS(=O)(=O)c1ccc(Nc2nccc(-c3ccc(Br)cc3)n2)cc1Molecular Processing
Molecular formula
C16H13BrN4O2S
Molecular weight
405.28
Exact mass
403.9943
XLogP
3.3
TPSA
97.97
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
24
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0
Molar refractivity
96.27
Supplementary Information
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