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Moligand™, ≥98% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads 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.
Information
MPO-IN-28 MPO-IN-28 (Compound 28) is an inhibitor of myeloperoxidase (MPO) with IC50 of 44 nM.
Targets
MPO (Cell-free assay) 44 nM
| ALogP | 1.14 |
|---|---|
| hba_count | 4 |
| Recuento HBD | 2 |
| Enlace rotable | 2 |
| Pubchem Sid | 504762230 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504762230 |
| Sonrisas canónicas | CC1=C2C=CC(=CC2=NC(=N1)N=C(N)N)OC |
| IUPAC Name | 2-(7-methoxy-4-methylquinazolin-2-yl)guanidine |
| InChIKey | ZJBMSSBTCGJZEE-UHFFFAOYSA-N |
| INCHI | 1S/C11H13N5O/c1-6-8-4-3-7(17-2)5-9(8)15-11(14-6)16-10(12)13/h3-5H,1-2H3,(H4,12,13,14,15,16) |
| Isómeros SMILES | CC1=C2C=CC(=CC2=NC(=N1)N=C(N)N)OC |
| Términos de entrada MeSH | 2-(7-methoxy-4-methylquinazolin-2-yl)guanidine |
| Peso molecular | 231.25 |
| Reaxy-Rn | 31545131 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=31545131&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Clase | Diazanaphthalenes |
| Subclass | Benzodiazines |
| Intermediate Tree Nodes | Quinazolines |
| Direct Parent | Quinazolinamines |
| Alternative Parents | Anisoles Alkyl aryl ethers Pyrimidines and pyrimidine derivatives Heteroaromatic compounds Guanidines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Quinazolinamine - Anisole - Alkyl aryl ether - Pyrimidine - Benzenoid - Heteroaromatic compound - Guanidine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Ether - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as quinazolinamines. These are heterocyclic aromatic compounds containing a quianazoline moiety substituted by one or more amine groups. |
| External Descriptors | Not available |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
| Certificate of Analysis | Jul 10, 2025 | M412317 | |
| Certificate of Analysis | Jul 10, 2025 | M412317 | |
| Certificate of Analysis | Jul 10, 2025 | M412317 | |
| Certificate of Analysis | Jul 10, 2025 | M412317 | |
| Certificate of Analysis | Jun 17, 2022 | M412317 |
| Solubilidad | Solubility (25°C) In vitro DMSO: 46 mg/mL (198.91 mM); Water: Insoluble; Ethanol: Insoluble; |
|---|---|
| DMSO (mg/ml) Solubilidad máxima | 46 |
| DMSO (mM) Solubilidad máxima | 198.918918918919 |
| Agua (mg/ml) Solubilidad máxima | <1 |
| Peso molecular | 231.250 g/mol |
| XLogP3 | 0.700 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 231.112 Da |
| Monoisotopic Mass | 231.112 Da |
| Topological Polar Surface Area | 99.400 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 292.000 |
| 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 |
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