CC(=O)OC(CCCN(CCCCCCC(=O)O)S(C)(=O)=O)COc1ccc(F)cc1
SMILES: CC(=O)OC(CCCN(CCCCCCC(=O)O)S(C)(=O)=O)COc1ccc(F)cc1

Molecular Processing

Molecular formula
C21H32FNO7S
Molecular weight
461.55
Exact mass
461.1884
XLogP
3.21
TPSA
110.21
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
16
Heavy atoms
31
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.619
Molar refractivity
113.82

Supplementary Information

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