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(2R,2R) -PF-07258669

CAT: 0013-GTR19236292-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19236292-01Size:25 mg
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Description
(2R,2'R) -PF-07258669 is a selective MC4R antagonist used in metabolic research. It is a valuable tool compound for in vitro binding assays and in vivo studies investigating the receptor's role in energy homeostasis, appetite regulation, and body weight control.
CAS Number
2755890-68-5
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
C ([C@H] (C) C=1C=C (OC) N=CC1F) (=O) N2C[C@]3 (NC=4C (CC3) =CC (=C (C) N4) C=5N=CC=CN5) CC2
Molecular Formula
C25H27FN6O2
Molecular Weight
462.52
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

WF3Qyf69YU
CAS Number2755890-68-5
PubChem CID166177215
IUPAC Name(2R)-2-(5-fluoro-2-methoxy-4-pyridinyl)-1-[(2R)-7-methyl-6-pyrimidin-2-ylspiro[3,4-dihydro-1H-1,8-naphthyridine-2,3'-pyrrolidine]-1'-yl]propan-1-one
Molecular FormulaC25H27FN6O2
Molecular Weight462.5
XLogP2.9
Topological Polar Surface Area93.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count34
Formal Charge0
Complexity724
SMILES
CC1=C(C=C2CC[C@]3(CCN(C3)C(=O)[C@H](C)C4=CC(=NC=C4F)OC)NC2=N1)C5=NC=CC=N5
InChI
InChI=1S/C25H27FN6O2/c1-15(18-12-21(34-3)29-13-20(18)26)24(33)32-10-7-25(14-32)6-5-17-11-19(16(2)30-22(17)31-25)23-27-8-4-9-28-23/h4,8-9,11-13,15H,5-7,10,14H2,1-3H3,(H,30,31)/t15-,25-/m1/s1
InChIKey
PARGFYLSRQUWHR-SGANQWHYSA-N
Chemical Structure
2D Structure
2D structure of WF3Qyf69YU
CAS: 2755890-68-5
CID: 166177215
Formula: C25H27FN6O2
MW: 462.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight462.5
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass462.21795229
Monoisotopic Mass462.21795229
Topological Polar Surface Area93.1 Ų
Heavy Atom Count34
Formal Charge0
Complexity724
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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