名称: (S)-(+)-5′nitrospiro[1-azabicyclo[2.2.2]octane-3,2′(3′H)-furo[2,3-b]pyridine]
SMILES:
O=[N+]([O-])c1cnc2c(c1)C[C@]1(CN3CCC1CC3)O2Molecular Processing
Molecular formula
C13H15N3O3
Molecular weight
261.28
Exact mass
261.1113
XLogP
1.39
TPSA
68.5
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
19
Rings
5
Aromatic rings
1
Saturated rings
3
Aliphatic rings
4
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.615
Molar refractivity
67.12
Supplementary Information
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