CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)[C@H]1CO[C@@H](CO)CN1C(=O)OC(C)(C)C
SMILES: CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)[C@H]1CO[C@@H](CO)CN1C(=O)OC(C)(C)C

Molecular Processing

Molecular formula
C21H30F2N2O6
Molecular weight
444.48
Exact mass
444.2072
XLogP
1.37
TPSA
108.33
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
31
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.619
Molar refractivity
107.23

Supplementary Information

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