SMILES:
N#Cc1ccc(N(Cc2ccc(OS(N)(=O)=O)c(Cl)c2)n2cnnc2)cc1Molecular Processing
Molecular formula
C16H13ClN6O3S
Molecular weight
404.84
Exact mass
404.0458
XLogP
1.86
TPSA
127.13
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
27
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.062
Molar refractivity
97.95
Supplementary Information
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