Products for Research Use Only

T-226296

CAT: 0013-GTR19196384-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19196384-01Size:25 mg
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Description
T-226296 is a selective small molecule antagonist of the melanin-concentrating hormone receptor 1 (MCHR1) . It is a valuable research tool for investigating the role of the MCH system in energy homeostasis, sleep, and mood regulation in both in vitro and in vivo models.
CAS Number
331758-35-1
Field of Research
Metabolism Research, Pharmacology & Drug Discovery
Smiles
N (C (=O) C1=CC=C (C=C1) C2=CC=C (F) C=C2) C=3C=C4C (CC (CN (C) C) CC4) =CC3
Molecular Formula
C26H27FN2O
Molecular Weight
402.5
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

T-226296

structure in first source

CAS Number331758-35-1
PubChem CID9865843
IUPAC NameN-[6-[(dimethylamino)methyl]-5,6,7,8-tetrahydronaphthalen-2-yl]-4-(4-fluorophenyl)benzamide
Molecular FormulaC26H27FN2O
Molecular Weight402.5
XLogP5.4
Topological Polar Surface Area32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count30
Formal Charge0
Complexity551
SMILES
CN(C)CC1CCC2=C(C1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)F
InChI
InChI=1S/C26H27FN2O/c1-29(2)17-18-3-4-23-16-25(14-11-22(23)15-18)28-26(30)21-7-5-19(6-8-21)20-9-12-24(27)13-10-20/h5-14,16,18H,3-4,15,17H2,1-2H3,(H,28,30)
InChIKey
GXAQELJVODWLDD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of T-226296
CAS: 331758-35-1
CID: 9865843
Formula: C26H27FN2O
MW: 402.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight402.5
XLogP35.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass402.21074165
Monoisotopic Mass402.21074165
Topological Polar Surface Area32.3 Ų
Heavy Atom Count30
Formal Charge0
Complexity551
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes