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PF-06282999

CAT: 0127-BUP10231-03Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0127-BUP10231-03Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1435467-37-0
Purity
=98%
Smiles
COc1ccc(Cl)cc1-c1cc(=O)[nH]c(=S)n1CC(N)=O

Chemical Information

Pf-06282999

Pf 06282999 is under investigation in clinical trial NCT01626976 (A Study To Assess The Safety, Tolerability And Pharmacokinetics Of PF-06282999 Administered Orally In Healthy Adult Subjects).

CAS Number1435467-37-0
PubChem CID71571306
IUPAC Name2-[6-(5-chloro-2-methoxyphenyl)-4-oxo-2-sulfanylidenepyrimidin-1-yl]acetamide
Molecular FormulaC13H12ClN3O3S
Molecular Weight325.77
XLogP1
Topological Polar Surface Area117
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count21
Formal Charge0
Complexity497
SMILES
COC1=C(C=C(C=C1)Cl)C2=CC(=O)NC(=S)N2CC(=O)N
InChI
InChI=1S/C13H12ClN3O3S/c1-20-10-3-2-7(14)4-8(10)9-5-12(19)16-13(21)17(9)6-11(15)18/h2-5H,6H2,1H3,(H2,15,18)(H,16,19,21)
InChIKey
ICYNYWFGIDGBRD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pf-06282999
CAS: 1435467-37-0
CID: 71571306
Formula: C13H12ClN3O3S
MW: 325.77
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight325.77
XLogP31
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass325.0287901
Monoisotopic Mass325.0287901
Topological Polar Surface Area117 Ų
Heavy Atom Count21
Formal Charge0
Complexity497
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

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Alternative Products

CatalogName
522473PF-06282999
A12517-100PF-06282999 100mg
A12517-50PF-06282999 50mg
A12517-25PF-06282999 25mg
HY-19321R-01PF-06282999 (Standard)
A12517-200PF-06282999 200mg
A12517-5PF-06282999 5mg

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