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GR 46611

CAT: 1410-M27631-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M27631-02Size:5 mg
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Description
GR 46611 is a selective 5-HT1B and 5-HT1D receptor agonist and can be used in studies about the treatment of epilepsy.
CAS Number
185259-85-2
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
377.488
Molecular Formula
C23H27N3O2
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

GR 46611

3-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]-N-[(4-methoxyphenyl)methyl]-2-propenamide is a member of tryptamines.

CAS Number185259-85-2
PubChem CID6160690
IUPAC Name(E)-3-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]-N-[(4-methoxyphenyl)methyl]prop-2-enamide
Molecular FormulaC23H27N3O2
Molecular Weight377.5
XLogP3.2
Topological Polar Surface Area57.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Heavy Atom Count28
Formal Charge0
Complexity514
SMILES
CN(C)CCC1=CNC2=C1C=C(C=C2)/C=C/C(=O)NCC3=CC=C(C=C3)OC
InChI
InChI=1S/C23H27N3O2/c1-26(2)13-12-19-16-24-22-10-6-17(14-21(19)22)7-11-23(27)25-15-18-4-8-20(28-3)9-5-18/h4-11,14,16,24H,12-13,15H2,1-3H3,(H,25,27)/b11-7+
InChIKey
LBVZWEWTNUDWNS-YRNVUSSQSA-N
Chemical Structure
2D Structure
2D structure of GR 46611
CAS: 185259-85-2
CID: 6160690
Formula: C23H27N3O2
MW: 377.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight377.5
XLogP33.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Exact Mass377.21032711
Monoisotopic Mass377.21032711
Topological Polar Surface Area57.4 Ų
Heavy Atom Count28
Formal Charge0
Complexity514
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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HY-101248-01GR-46611

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