SMILES:
O=C(Nc1ccc(C2CCNCC2)cc1)c1nc(-c2ccccc2)oc1C(F)(F)FMolecular Processing
Molecular formula
C22H20F3N3O2
Molecular weight
415.42
Exact mass
415.1508
XLogP
5.08
TPSA
67.16
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
106.18
Supplementary Information
Details werden geladen…
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