CCCC(Cc1ccc(OCCN2CCCCCC2)cc1)(C(=O)O)S(=O)(=O)c1ccc(OC)cc1
SMILES: CCCC(Cc1ccc(OCCN2CCCCCC2)cc1)(C(=O)O)S(=O)(=O)c1ccc(OC)cc1

Molecular Processing

Molecular formula
C27H37NO6S
Molecular weight
503.66
Exact mass
503.2342
XLogP
4.59
TPSA
93.14
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
12
Heavy atoms
35
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.519
Molar refractivity
136

Supplementary Information

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