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SIB 1663

CAT: 0013-GTR19273474-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19273474-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
SIB 1663 is a conformationally restricted nicotine analogue. It selectively activates the α2β4 and α4β4 subtypes of human recombinant neuronal nicotinic acetylcholine receptors (nAChRs) . Additionally, SIB 1663 enhances the release of dopamine and noradrenaline and is applicable in the study of neurological disorders.
CAS Number
179064-11-0
Smiles
N=1C=C2C (=CC1OC) CCC3CCNC23
Molecular Formula
C12H16N2O
Molecular Weight
204.27
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

7-Methoxy-2,3,3a,4,5,9b-hexahydro-1H-pyrrolo[3,2-h]isoquinoline
CAS Number179064-11-0
PubChem CID10219887
IUPAC Name7-methoxy-2,3,3a,4,5,9b-hexahydro-1H-pyrrolo[3,2-h]isoquinoline
Molecular FormulaC12H16N2O
Molecular Weight204.27
XLogP1.3
Topological Polar Surface Area34.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count15
Formal Charge0
Complexity234
SMILES
COC1=NC=C2C3C(CCC2=C1)CCN3
InChI
InChI=1S/C12H16N2O/c1-15-11-6-9-3-2-8-4-5-13-12(8)10(9)7-14-11/h6-8,12-13H,2-5H2,1H3
InChIKey
PXBSPNGMNRTLCH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7-Methoxy-2,3,3a,4,5,9b-hexahydro-1H-pyrrolo[3,2-h]isoquinoline
CAS: 179064-11-0
CID: 10219887
Formula: C12H16N2O
MW: 204.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight204.27
XLogP31.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass204.126263138
Monoisotopic Mass204.126263138
Topological Polar Surface Area34.2 Ų
Heavy Atom Count15
Formal Charge0
Complexity234
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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