Name: 2-(6,7-dimethoxy-quinoxalin-2-yl)-2-aza-bicyclo[2.2.2]octan-3-one
SMILES:
COc1cc2ncc(N3C(=O)C4CCC3CC4)nc2cc1OCMolecular Processing
Molecular formula
C17H19N3O3
Molecular weight
313.36
Exact mass
313.1426
XLogP
2.55
TPSA
64.55
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
23
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.471
Molar refractivity
85.87
Supplementary Information
Details werden geladen…
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