Cc1cc(-c2ccc(Cl)c(C)c2)nc(-c2cccc(-c3cccc(S(N)(=O)=O)c3)c2)n1
SMILES: Cc1cc(-c2ccc(Cl)c(C)c2)nc(-c2cccc(-c3cccc(S(N)(=O)=O)c3)c2)n1

Molecular Processing

Molecular formula
C24H20ClN3O2S
Molecular weight
449.96
Exact mass
449.0965
XLogP
5.4
TPSA
85.94
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
31
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.083
Molar refractivity
124.2

Supplementary Information

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