SMILES:
C[C@@H](CN1CCN(c2cc(F)ccc2F)CC1)N1C(=O)CC2(CCCC2)CC1=OMolecular Processing
Molecular formula
C22H29F2N3O2
Molecular weight
405.49
Exact mass
405.2228
XLogP
3.18
TPSA
43.86
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
29
Rings
4
Aromatic rings
1
Saturated rings
3
Aliphatic rings
3
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.636
Molar refractivity
106.46
Supplementary Information
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