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TRV0109101

CAT: 0013-GTR19209086-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19209086-02Size:50 mg
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Description
TRV0109101 is a μ-opioid receptor agonist exhibiting G protein signaling bias. This profile makes it a valuable research tool for investigating biased agonism in models of pain and addiction, with applications in both in vitro signaling assays and in vivo behavioral studies.
CAS Number
1401027-29-9
Smiles
C (CNCC1=CC=CS1) [C@@]2 (CC3 (OCC2) CCCC3) C4=CC=CC=N4
Molecular Formula
C21H28N2OS
Molecular Weight
356.52
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

CID 72712370
CAS Number1401027-29-9
PubChem CID72712370
IUPAC Name2-[(9R)-9-pyridin-2-yl-6-oxaspiro[4.5]decan-9-yl]-N-(thiophen-2-ylmethyl)ethanamine
Molecular FormulaC21H28N2OS
Molecular Weight356.5
XLogP3.5
Topological Polar Surface Area62.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count25
Formal Charge0
Complexity426
SMILES
C1CCC2(C1)C[C@](CCO2)(CCNCC3=CC=CS3)C4=CC=CC=N4
InChI
InChI=1S/C21H28N2OS/c1-4-12-23-19(7-1)20(10-13-22-16-18-6-5-15-25-18)11-14-24-21(17-20)8-2-3-9-21/h1,4-7,12,15,22H,2-3,8-11,13-14,16-17H2/t20-/m1/s1
InChIKey
PJLIHYXPEOMIMJ-HXUWFJFHSA-N
Chemical Structure
2D Structure
2D structure of CID 72712370
CAS: 1401027-29-9
CID: 72712370
Formula: C21H28N2OS
MW: 356.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight356.5
XLogP33.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass356.19223469
Monoisotopic Mass356.19223469
Topological Polar Surface Area62.4 Ų
Heavy Atom Count25
Formal Charge0
Complexity426
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
T70765-01TRV0109101

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