SMILES:
CN=S(=O)(NC(=O)Nc1nc(OC)cc(OC)n1)c1ccccc1BrMolecular Processing
Molecular formula
C14H16BrN5O4S
Molecular weight
430.28
Exact mass
429.0106
XLogP
2.45
TPSA
114.8
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
96.19
Supplementary Information
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