Cc1ccc(S(=O)(=O)OCC2Cc3c(Cl)cc4c(c3O2)CCC4)cc1
SMILES: Cc1ccc(S(=O)(=O)OCC2Cc3c(Cl)cc4c(c3O2)CCC4)cc1

Molecular Processing

Molecular formula
C19H19ClO4S
Molecular weight
378.88
Exact mass
378.0693
XLogP
3.85
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
25
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.368
Molar refractivity
95.91

Supplementary Information

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