O=C(NC(CC(F)(F)F)C(=O)NC(Cc1ccccc1)(c1ccc(F)cc1)c1cc(F)cc(OC(F)(F)C(F)F)c1)OCC1c2ccccc2-c2ccccc21
SMILES: O=C(NC(CC(F)(F)F)C(=O)NC(Cc1ccccc1)(c1ccc(F)cc1)c1cc(F)cc(OC(F)(F)C(F)F)c1)OCC1c2ccccc2-c2ccccc21

Molecular Processing

Molecular formula
C41H31F9N2O4
Molecular weight
786.69
Exact mass
786.214
XLogP
9.66
TPSA
76.66
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
13
Heavy atoms
56
Rings
6
Aromatic rings
5
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
15
Covalent units
1
Fraction Csp3
0.22
Molar refractivity
186.11

Supplementary Information

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