CCOC(=O)C1CCCC1N(CCC(C)C)C(=O)CC1=NS(=O)(=O)c2cc(NS(C)(=O)=O)ccc2N1
SMILES: CCOC(=O)C1CCCC1N(CCC(C)C)C(=O)CC1=NS(=O)(=O)c2cc(NS(C)(=O)=O)ccc2N1

Molecular Processing

Molecular formula
C23H34N4O7S2
Molecular weight
542.68
Exact mass
542.1869
XLogP
2.57
TPSA
151.31
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
10
Heavy atoms
36
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.609
Molar refractivity
136.7

Supplementary Information

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