Cc1ccc(S(=O)(=O)OCCC(c2ccccc2)c2cc(Br)ccc2OCc2ccccc2)cc1
SMILES: Cc1ccc(S(=O)(=O)OCCC(c2ccccc2)c2cc(Br)ccc2OCc2ccccc2)cc1

Molecular Processing

Molecular formula
C29H27BrO4S
Molecular weight
551.5
Exact mass
550.0813
XLogP
7.26
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
10
Heavy atoms
35
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.172
Molar refractivity
142.13

Supplementary Information

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