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(S) -PF 03716556

CAT: 0804-HY-13100A-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-13100A-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
(S) -PF 03716556 is a K+-competitive acid blocker with gastric acid pump inhibitory activity. (S) -PF 03716556 can be used to inhibit disease states mediated by acid pump inhibitory activity[1].
CAS Number
928774-44-1
UNSPSC
12352005
Target
Potassium Channel
Type
Reference compound
Related Pathways
Membrane Transporter/Ion Channel
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Metabolic Disease
Assay Protocol
https://www.medchemexpress.com/s-pf-03716556.html
Smiles
OCCN(C)C(C1=CN2C(C(N[C@@H]3C4=C(C)C=CC=C4OCC3)=C1)=NC(C)=C2)=O
Molecular Formula
C22H26N4O3
Molecular Weight
394.47
References & Citations
[1]Structural Basis for Binding of Potassium-Competitive Acid Blockers to the Gastric Proton Pump
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

N-(2-hydroxyethyl)-N,2-dimethyl-8-[[(4S)-5-methyl-3,4-dihydro-2H-chromen-4-yl]amino]imidazo[1,2-a]pyridine-6-carboxamide
CAS Number928774-44-1
PubChem CID124399702
IUPAC NameN-(2-hydroxyethyl)-N,2-dimethyl-8-[[(4S)-5-methyl-3,4-dihydro-2H-chromen-4-yl]amino]imidazo[1,2-a]pyridine-6-carboxamide
Molecular FormulaC22H26N4O3
Molecular Weight394.5
XLogP2.9
Topological Polar Surface Area79.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count29
Formal Charge0
Complexity576
SMILES
CC1=C2[C@H](CCOC2=CC=C1)NC3=CC(=CN4C3=NC(=C4)C)C(=O)N(C)CCO
InChI
InChI=1S/C22H26N4O3/c1-14-5-4-6-19-20(14)17(7-10-29-19)24-18-11-16(22(28)25(3)8-9-27)13-26-12-15(2)23-21(18)26/h4-6,11-13,17,24,27H,7-10H2,1-3H3/t17-/m0/s1
InChIKey
YBHKBMJREUZHOV-KRWDZBQOSA-N
Chemical Structure
2D Structure
2D structure of N-(2-hydroxyethyl)-N,2-dimethyl-8-[[(4S)-5-methyl-3,4-dihydro-2H-chromen-4-yl]amino]imidazo[1,2-a]pyridine-6-carboxamide
CAS: 928774-44-1
CID: 124399702
Formula: C22H26N4O3
MW: 394.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight394.5
XLogP32.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass394.20049070
Monoisotopic Mass394.20049070
Topological Polar Surface Area79.1 Ų
Heavy Atom Count29
Formal Charge0
Complexity576
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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