CCCOc1cc(F)cc(CC(N)C(O)C2COC(OCC(C)(CF)CF)C(C)N2C(=O)OC(C)(C)C)c1
SMILES: CCCOc1cc(F)cc(CC(N)C(O)C2COC(OCC(C)(CF)CF)C(C)N2C(=O)OC(C)(C)C)c1

Molecular Processing

Molecular formula
C27H43F3N2O6
Molecular weight
548.64
Exact mass
548.3073
XLogP
4.16
TPSA
103.48
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
12
Heavy atoms
38
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
5
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.741
Molar refractivity
136.94

Supplementary Information

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