≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C,Protected from light,Desiccated Ships Wet ice Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
DA 3003-2 is a potent and selectively Cdc25 inhibitor. DA 3003-2 shows antiproliferative activity. DA 3003-2 induces cell cycle arrest at the G2/M phase and increases the expression of P-tyr 15 Cdc2. DA 3003-2 has the potential for the research of prostate cancer.
In Vitro
DA 3003-2 (0.3-30 µM; 48 h) shows antiproliferative activity with an IC 50 value of 5 µM in PC-3 cells. DA 3003-2 (5, 10 µM; 24, 1 h) induces cell cycle arrest at G2/M phase and increases the expression of P-tyr 15 Cdc2 in PC-3 cells. MCE has not independently confirmed the accuracy of these methods. They are for reference only. Cell Cytotoxicity AssayCell Line: PC-3 cells Concentration: 0.3-30 µM Incubation Time: 48 h Result: Showed antiproliferative efficacy in a dose-dependent manner with an IC 50 value of 5 µM. Cell Cycle AnalysisCell Line: PC-3 cells Concentration: 5, 10 µM Incubation Time: 24 h Result: Induced cell cycle arrest at G2/M phase. Western Blot AnalysisCell Line: PC-3 cells Concentration: 5, 10 µM Incubation Time: 1 h Result: Increased the expression of P-tyr 15 Cdc2.
Form:Solid
| Sonrisas canónicas | C1COCCN1CCNC2=C(C(=O)C3=C(C2=O)C=CC=N3)Cl |
|---|---|
| IUPAC Name | 7-chloro-6-(2-morpholin-4-ylethylamino)quinoline-5,8-dione |
| InChIKey | LGTBDMBBPVNDSZ-UHFFFAOYSA-N |
| INCHI | 1S/C15H16ClN3O3/c16-11-13(18-4-5-19-6-8-22-9-7-19)14(20)10-2-1-3-17-12(10)15(11)21/h1-3,18H,4-9H2 |
| Isómeros SMILES | C1COCCN1CCNC2=C(C(=O)C3=C(C2=O)C=CC=N3)Cl |
| PubChem CID | 379078 |
| Número NSC | 663285 |
| Peso molecular | 321.76 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
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View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Clase | Quinolines and derivatives |
| Subclass | Quinoline quinones |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Quinoline quinones |
| Alternative Parents | Hydroquinolines Aryl ketones Morpholines Pyridines and derivatives Vinylogous halides Alpha-chloroketones Vinylogous amides Heteroaromatic compounds Trialkylamines Oxacyclic compounds Enamines Dialkylamines Dialkyl ethers Chloroalkenes Azacyclic compounds Vinyl chlorides Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Quinoline quinone - Dihydroquinoline - Aryl ketone - Morpholine - Oxazinane - Pyridine - Alpha-haloketone - Alpha-chloroketone - Heteroaromatic compound - Vinylogous amide - Vinylogous halide - Ketone - Tertiary amine - Tertiary aliphatic amine - Dialkyl ether - Secondary aliphatic amine - Enamine - Ether - Oxacycle - Secondary amine - Azacycle - Chloroalkene - Vinyl chloride - Vinyl halide - Haloalkene - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as quinoline quinones. These are quinoline derivative with a structure containing a 5,8-dihydroisoquinoline-5,8-dione skeleton. |
| External Descriptors | Not available |
| Activity Type | Activity Value -log(M) | Mechanism of Action | Activity Reference | Publications (PubMed IDs) |
|---|
| Solubilidad | DMSO : 150 mg/mL (466.19 mM; Need ultrasonic) |
|---|---|
| Peso molecular | 321.760 g/mol |
| XLogP3 | 1.400 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 321.088 Da |
| Monoisotopic Mass | 321.088 Da |
| Topological Polar Surface Area | 71.500 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 488.000 |
| 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 | 1 |
