Name: N-[(3R)-1-azabicyclo[2.2.2]oct-3-yl]-7-cyano-1-benzo-thiophene-2-carboxamide hydrochloride
SMILES:
Cl.N#Cc1cccc2cc(C(=O)N[C@H]3CN4CCC3CC4)sc12Molecular Processing
Molecular formula
C17H18ClN3OS
Molecular weight
347.87
Exact mass
347.0859
XLogP
3.02
TPSA
56.13
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
23
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0.412
Molar refractivity
94.21
Supplementary Information
Details werden geladen…
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