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| SKU | Size | Availability |
Price | Qty |
|---|---|---|---|---|
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G288263-10mg
|
10mg |
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
|
$205.90
|
|
|
G288263-50mg
|
50mg |
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
|
$846.90
|
|
Inactive isomer ofGSK J4; cell permeable
| Synonyms | N-[2-(3-Pyridinyl)-6-(1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)-4-pyrimidinyl]-β-alanine ethyl ester hydrochloride |
|---|---|
| Specifications & Purity | ≥98%(HPLC) |
| Biochemical and Physiological Mechanisms | Inactive isomer ofGSK J4; also cell permeable ester derivative of the inactive control,GSK J2.Active Analogalso available. |
| Storage Temp | Room temperature |
| Shipped In | Normal |
| IUPAC Name | ethyl 3-[[2-pyridin-3-yl-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-4-yl]amino]propanoate;hydrochloride |
|---|---|
| INCHI | InChI=1S/C24H27N5O2.ClH/c1-2-31-23(30)9-13-26-21-16-22(28-24(27-21)20-8-5-12-25-17-20)29-14-10-18-6-3-4-7-19(18)11-15-29;/h3-8,12,16-17H,2,9-11,13-15H2,1H3,(H,26,27,28);1H |
| InChIKey | QQHQMHJAOKADED-UHFFFAOYSA-N |
| Smiles | CCOC(=O)CCNC1=CC(=NC(=N1)C2=CN=CC=C2)N3CCC4=CC=CC=C4CC3.Cl |
| PubChem CID | 126456082 |
| Molecular Weight | 453.97 |
| Solubility | Solvent:DMSO, Max Conc. mg/mL: 22.7, Max Conc. mM: 50 |
|---|---|
| Molecular Weight | 454.000 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 8 |
| Exact Mass | 453.193 Da |
| Monoisotopic Mass | 453.193 Da |
| Topological Polar Surface Area | 80.200 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 546.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 2 |