COc1ccc(S(=O)(=O)Nc2cc(C(=O)Nc3ccccc3)cc(OCCO)c2Oc2cc(OC)ccc2Cl)cc1
SMILES: COc1ccc(S(=O)(=O)Nc2cc(C(=O)Nc3ccccc3)cc(OCCO)c2Oc2cc(OC)ccc2Cl)cc1

Molecular Processing

Molecular formula
C29H27ClN2O8S
Molecular weight
599.06
Exact mass
598.1177
XLogP
5.57
TPSA
132.42
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
12
Heavy atoms
41
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.138
Molar refractivity
155.3

Supplementary Information

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