SMILES:
COC(=O)C(CCN1CCC2(CC2)C(O)C1)N1CCN(c2cccc(C(F)(F)F)c2)CCC1=OMolecular Processing
Molecular formula
C24H32F3N3O4
Molecular weight
483.53
Exact mass
483.2345
XLogP
2.52
TPSA
73.32
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
34
Rings
4
Aromatic rings
1
Saturated rings
3
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
119.14
Supplementary Information
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