CCC1CCN(C(=O)C(CCCNC(=O)OCc2ccccc2)NS(=O)(=O)c2cccc3c(N(C)C)cccc23)CC1
SMILES: CCC1CCN(C(=O)C(CCCNC(=O)OCc2ccccc2)NS(=O)(=O)c2cccc3c(N(C)C)cccc23)CC1

Molecular Processing

Molecular formula
C32H42N4O5S
Molecular weight
594.78
Exact mass
594.2876
XLogP
4.91
TPSA
108.05
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
12
Heavy atoms
42
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
165.84

Supplementary Information

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