CC(C)(C)OC(=O)N1CCOC(Cc2ccc(OS(=O)(=O)C(F)(F)F)c(Cl)c2)C1
SMILES: CC(C)(C)OC(=O)N1CCOC(Cc2ccc(OS(=O)(=O)C(F)(F)F)c(Cl)c2)C1

Molecular Processing

Molecular formula
C17H21ClF3NO6S
Molecular weight
459.87
Exact mass
459.073
XLogP
3.75
TPSA
82.14
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
29
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.588
Molar refractivity
98.31

Supplementary Information

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