CC(=O)SCC(CCC(=O)C(C)C)C(=O)N1CCC[C@H]1C(=O)OC(C)(C)C
SMILES: CC(=O)SCC(CCC(=O)C(C)C)C(=O)N1CCC[C@H]1C(=O)OC(C)(C)C

Molecular Processing

Molecular formula
C20H33NO5S
Molecular weight
399.55
Exact mass
399.2079
XLogP
3.22
TPSA
80.75
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
27
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.8
Molar refractivity
106.29

Supplementary Information

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