CCC(CC)c1cc(-c2nc(-c3cc(C)c(NS(C)(=O)=O)c(Cl)c3)no2)cc(OC)n1
SMILES: CCC(CC)c1cc(-c2nc(-c3cc(C)c(NS(C)(=O)=O)c(Cl)c3)no2)cc(OC)n1

Molecular Processing

Molecular formula
C21H25ClN4O4S
Molecular weight
464.98
Exact mass
464.1285
XLogP
5.04
TPSA
107.21
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
31
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
121.05

Supplementary Information

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