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TIK-301

CAT: 0013-GTR19202997-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19202997-02Size:50 mg
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Description
TIK-301 is an orally bioavailable, chlorinated melatonin analog functioning as a potent agonist at MT1 and MT2 receptors (Ki values 0.081 nM and 0.042 nM) and an antagonist at 5-HT2B/2C receptors. Its pharmacological profile supports research into circadian rhythm and sleep disorders, as well as depression, with applications in both in vitro binding assays and in vivo behavioral studies.
CAS Number
118702-11-7
Field of Research
Neuroscience, Pharmacology & Drug Discovery, Signal Transduction
Smiles
[C@@H] (CNC (C) =O) (C) C=1C=2C (NC1) =CC (Cl) =C (OC) C2
Molecular Formula
C14H17ClN2O2
Molecular Weight
280.75
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-((2R)-2-(6-Chloro-5-methoxy-1H-indol-3-yl)propyl)acetamide
CAS Number118702-11-7
PubChem CID219018
IUPAC NameN-[(2R)-2-(6-chloro-5-methoxy-1H-indol-3-yl)propyl]acetamide
Molecular FormulaC14H17ClN2O2
Molecular Weight280.75
XLogP2.6
Topological Polar Surface Area54.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count19
Formal Charge0
Complexity327
SMILES
C[C@@H](CNC(=O)C)C1=CNC2=CC(=C(C=C21)OC)Cl
InChI
InChI=1S/C14H17ClN2O2/c1-8(6-16-9(2)18)11-7-17-13-5-12(15)14(19-3)4-10(11)13/h4-5,7-8,17H,6H2,1-3H3,(H,16,18)/t8-/m0/s1
InChIKey
RKHCTAKUYDTFHE-QMMMGPOBSA-N
Chemical Structure
2D Structure
2D structure of N-((2R)-2-(6-Chloro-5-methoxy-1H-indol-3-yl)propyl)acetamide
CAS: 118702-11-7
CID: 219018
Formula: C14H17ClN2O2
MW: 280.75
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight280.75
XLogP32.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass280.0978555
Monoisotopic Mass280.0978555
Topological Polar Surface Area54.1 Ų
Heavy Atom Count19
Formal Charge0
Complexity327
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

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