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GSK620

CAT: 0013-GTR19156512-07Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19156512-07Size:500 mg
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Description
GSK620 is a pan-BD2 inhibitor, which shows an anti-inflammatory phenotype in human whole blood with excellent broad selectivity, developability, and in vivo oral pharmacokinetics.GSK620 is highly selective for the BET-BD2 family of proteins, with >200-fold selectivity over all other bromodomains. GSK620 shows an anti-inflammatory phenotype in human whole blood.
CAS Number
2088410-46-0
Purity
>98% (HPLC)
Solubility
DMSO:62.5 mg/mL (192.09 mM; Need ultrasonic)
Smiles
CNC (=O) C1=CC (=CN (C1=O) CC2=CC=CC=C2) C (=O) NC3CC3
Molecular Formula
C18H19N3O3
Molecular Weight
325.4
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

1-Benzyl-N5-cyclopropyl-N3-methyl-2-oxo-1,2-dihydropyridine-3,5-dicarboxamide
CAS Number2088410-46-0
PubChem CID126648559
IUPAC Name1-benzyl-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
Molecular FormulaC18H19N3O3
Molecular Weight325.4
XLogP1.5
Topological Polar Surface Area78.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count24
Formal Charge0
Complexity599
SMILES
CNC(=O)C1=CC(=CN(C1=O)CC2=CC=CC=C2)C(=O)NC3CC3
InChI
InChI=1S/C18H19N3O3/c1-19-17(23)15-9-13(16(22)20-14-7-8-14)11-21(18(15)24)10-12-5-3-2-4-6-12/h2-6,9,11,14H,7-8,10H2,1H3,(H,19,23)(H,20,22)
InChIKey
QZZCUOVXHPAQRQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Benzyl-N5-cyclopropyl-N3-methyl-2-oxo-1,2-dihydropyridine-3,5-dicarboxamide
CAS: 2088410-46-0
CID: 126648559
Formula: C18H19N3O3
MW: 325.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight325.4
XLogP31.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass325.14264148
Monoisotopic Mass325.14264148
Topological Polar Surface Area78.5 Ų
Heavy Atom Count24
Formal Charge0
Complexity599
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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BA4681-100GSK620
A22521-100GSK620 100mg
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A22521-50GSK620 50mg
A22521-1GSK620 1mg
A22521-5GSK620 5mg
A22521-500GSK620 500mg
A22521-10GSK620 10mg
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