Products for Research Use Only

AT-090

CAT: 0013-GTR19242275-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19242275-02Size:50 mg
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Description
AT-090 is a potent and selective nociceptin/orphanin FQ peptide (NOP) receptor agonist. This research compound is utilized in both in vitro and in vivo studies to investigate the NOP receptor's role in pain, addiction, and anxiety pathways.
CAS Number
2099681-59-9
Smiles
O=C1N (C=2C (C1=O) =CC=CC2) C3CCN (CC3) [C@@H]4CC[C@H] ([C@@H] (C) C) CC4
Molecular Formula
C22H30N2O2
Molecular Weight
354.49
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1-[1-(4-Propan-2-ylcyclohexyl)piperidin-4-yl]indole-2,3-dione
CAS Number2099681-59-9
PubChem CID129188471
IUPAC Name1-[1-(4-propan-2-ylcyclohexyl)piperidin-4-yl]indole-2,3-dione
Molecular FormulaC22H30N2O2
Molecular Weight354.5
XLogP4.3
Topological Polar Surface Area40.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count26
Formal Charge0
Complexity530
SMILES
CC(C)C1CCC(CC1)N2CCC(CC2)N3C4=CC=CC=C4C(=O)C3=O
InChI
InChI=1S/C22H30N2O2/c1-15(2)16-7-9-17(10-8-16)23-13-11-18(12-14-23)24-20-6-4-3-5-19(20)21(25)22(24)26/h3-6,15-18H,7-14H2,1-2H3
InChIKey
RCRPVEANWGMGSQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-[1-(4-Propan-2-ylcyclohexyl)piperidin-4-yl]indole-2,3-dione
CAS: 2099681-59-9
CID: 129188471
Formula: C22H30N2O2
MW: 354.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight354.5
XLogP34.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass354.230728204
Monoisotopic Mass354.230728204
Topological Polar Surface Area40.6 Ų
Heavy Atom Count26
Formal Charge0
Complexity530
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes