Clc1ccc(Cc2cc([C@@H]3O[C@H](COCc4ccccc4)[C@@H](OCc4ccccc4)[C@H](OCc4ccccc4)[C@H]3OCc3ccccc3)ccc2Cl)nn1
Nombre: compound 24
SMILES: Clc1ccc(Cc2cc([C@@H]3O[C@H](COCc4ccccc4)[C@@H](OCc4ccccc4)[C@H](OCc4ccccc4)[C@H]3OCc3ccccc3)ccc2Cl)nn1

Molecular Processing

Molecular formula
C45H42Cl2N2O5
Molecular weight
761.75
Exact mass
760.2471
XLogP
9.79
TPSA
71.93
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
16
Heavy atoms
54
Rings
7
Aromatic rings
6
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.244
Molar refractivity
210.07

Supplementary Information

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