SMILES:
CCOC(=O)CN1CC(C)(C)C(Oc2ccc(C#N)c(C(F)(F)F)c2)C1=OMolecular Processing
Molecular formula
C18H19F3N2O4
Molecular weight
384.35
Exact mass
384.1297
XLogP
2.76
TPSA
79.63
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
27
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
87.57
Supplementary Information
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