CAS 115104-28-4|UNII:76LB1G2X6V
Introduction：Basic information about CAS 115104-28-4|UNII:76LB1G2X6V, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | UNII:76LB1G2X6V | ||
|---|---|---|---|
| CAS Number | 115104-28-4 | Molecular Weight | 515.09 |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 712.3±60.0 °C at 760 mmHg |
| Molecular Formula | C26H27ClN2O3S2 | Melting Point | / |
| MSDS | / | Flash Point | 384.6±32.9 °C |
Names
| Name | MK 571,3-[[[3-[(1E)-2-(7-Chloro-2-quinolinyl)ethenyl]phenyl][[3-(dimethylamino)-3-oxopropyl]thio]methyl]thio]propanoicacid |
|---|---|
| Synonym | More Synonyms |
UNII:76LB1G2X6V BiologicalActivity
| Description | MK-571 (L-660711) is an orally active, potent and selective competitive leukotriene D4 (LTD4) receptor antagonist, with Ki values of 0.22 and 2.1 nM in guinea pig and human lung membranes, respectively. MK-571 is also a MRP4 and ABCC1 (MRP1) inhibitor. MK-571 inhibits constitutive and antigen-stimulated S1P (sphingosine-1-phosphate) release[1][2][3]. |
|---|---|
| Related Catalog | Signaling Pathways >>GPCR/G Protein >>Leukotriene ReceptorSignaling Pathways >>GPCR/G Protein >>LPL ReceptorResearch Areas >>Inflammation/Immunology |
| Target | LTD4:0.22 nM (Ki, In guinea pig lung) LTD4:2.1 nM (Ki, In human lung) LTD4:10.5 (pA2, on guinea pig ileum) LTE4:10.4 (pA2, on guinea pig ileum) |
| References | [1]. Jones TR, et al. Pharmacology of L-660,711 (MK-571): a novel potent and selective leukotriene D4 receptor antagonist. Can J Physiol Pharmacol. 1989 Jan;67(1):17-28. [2]. Hara Y, et al. Inhibition of MRP4 prevents and reverses pulmonary hypertension in mice. J Clin Invest. 2011 Jul;121(7):2888-97. [3]. Mitra P, et al. Role of ABCC1 in export of sphingosine-1-phosphate from mast cells. Proc Natl Acad Sci U S A. 2006 Oct 31;103(44):16394-9. |
Chemical & Physical Properties
| Density | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 712.3±60.0 °C at 760 mmHg |
| Molecular Formula | C26H27ClN2O3S2 |
| Molecular Weight | 515.09 |
| Flash Point | 384.6±32.9 °C |
| Exact Mass | 514.115173 |
| PSA | 121.10000 |
| LogP | 5.93 |
| Vapour Pressure | 0.0±2.4 mmHg at 25°C |
| Index of Refraction | 1.687 |
| InChIKey | AXUZQJFHDNNPFG-UXBLZVDNSA-N |
| SMILES | CN(C)C(=O)CCSC(SCCC(=O)O)c1cccc(C=Cc2ccc3ccc(Cl)cc3n2)c1 |
| Storage condition | 20°C |
Safety Information
| Hazard Codes | Xn |
|---|---|
| Risk Phrases | 36/37/38 |
| Safety Phrases | 26-36/37 |
Synonyms
| 3-[({3-[(E)-2-(7-Chloroquinolin-2-yl)vinyl]phenyl}{[3-(dimethylamino)-3-oxopropyl]sulfanyl}methyl)sulfanyl]propanoic acid |
| mk-571,na salt |
| Propanoic acid, 3-[[[3-[(E)-2-(7-chloro-2-quinolinyl)ethenyl]phenyl][[3-(dimethylamino)-3-oxopropyl]thio]methyl]thio]- |
| mk-571 sodium salt |
| 3-[({3-[(E)-2-(7-Chloro-2-quinolinyl)vinyl]phenyl}{[3-(dimethylamino)-3-oxopropyl]sulfanyl}methyl)sulfanyl]propanoic acid |
| mk-571 na |
| UNII:76LB1G2X6V |
