Name: (R)-1-(3-methylpiperazin-1-yl)ethanone 2,2,2-trifluoroacetate
SMILES:
CC(=O)N1CCN[C@H](C)C1.O=C(O)C(F)(F)FMolecular Processing
Molecular formula
C9H15F3N2O3
Molecular weight
256.22
Exact mass
256.1035
XLogP
0.46
TPSA
69.64
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
17
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0.778
Molar refractivity
53.41
Supplementary Information
Details werden geladen…
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