Determine the necessary mass, volume, or concentration for preparing a solution.
| Activity Type | Activity Value -log(M) | Mechanism of Action | Activity Reference | Publications (PubMed IDs) |
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Moligand™, ≥97% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
A l'abri de la lumière,A conserver à -20°C Ships Glacière + blocs de glace 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 10 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
La mitoxantrone est un médicament intercalant l'ADN qui inhibe la synthèse de l'ADN et qui est utilisé comme agent anticancéreux. La mitoxantrone est un inhibiteur de Topo II.
| pKa | pKa: 7.08 (Predicted), pKa: 9.27 (Predicted) |
|---|---|
| Ki Data | mAChR M2: Ki= 77.9 nM (human); mAChR M4: Ki= 89.8 nM (human); mAChR M1: Ki= 0.18 μM (human); SR-2C: Ki= 1.87 μM (human); HERG: Ki= 2.94 μM (human) |
| Pubchem Sid | 488179822 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488179822 |
| Sourires canoniques | C1=CC(=C2C(=C1NCCNCCO)C(=O)C3=C(C=CC(=C3C2=O)O)O)NCCNCCO |
| IUPAC Name | 1,4-dihydroxy-5,8-bis[2-(2-hydroxyethylamino)ethylamino]anthracene-9,10-dione |
| InChIKey | KKZJGLLVHKMTCM-UHFFFAOYSA-N |
| INCHI | 1S/C22H28N4O6/c27-11-9-23-5-7-25-13-1-2-14(26-8-6-24-10-12-28)18-17(13)21(31)19-15(29)3-4-16(30)20(19)22(18)32/h1-4,23-30H,5-12H2 |
| Isomères SMILES | C1=CC(=C2C(=C1NCCNCCO)C(=O)C3=C(C=CC(=C3C2=O)O)O)NCCNCCO |
| RTECS | CB5748500 |
| Poids moléculaire | 444.48 |
| Beilstein | 2795126 |
| Reaxy-Rn | 2795126 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2795126&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 | Benzenoids |
| Classe | Anthracenes |
| Subclass | Anthraquinones |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Anthraquinones |
| Alternative Parents | Aryl ketones Secondary alkylarylamines 1-hydroxy-2-unsubstituted benzenoids Vinylogous amides Vinylogous acids 1,2-aminoalcohols Dialkylamines Primary alcohols Organopnictogen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homopolycyclic compounds |
| Substituents | 9,10-anthraquinone - Anthraquinone - Aryl ketone - 1-hydroxy-2-unsubstituted benzenoid - Secondary aliphatic/aromatic amine - Vinylogous acid - Vinylogous amide - 1,2-aminoalcohol - Ketone - Secondary amine - Secondary aliphatic amine - Alkanolamine - Organic oxide - Organopnictogen compound - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Alcohol - Hydrocarbon derivative - Aromatic homopolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as anthraquinones. These are organic compounds containing either anthracene-9,10-quinone, 1,4-anthraquinone, or 1,2-anthraquinone. |
| External Descriptors | hydroxyanthraquinones |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Article |
|---|---|---|---|
| Certificate of Analysis | May 14, 2026 | M339846 | |
| Certificate of Analysis | May 14, 2026 | M339846 | |
| Certificate of Analysis | May 14, 2026 | M339846 | |
| Certificate of Analysis | May 14, 2026 | M339846 | |
| Certificate of Analysis | Dec 10, 2025 | M339846 | |
| Certificate of Analysis | Dec 10, 2025 | M339846 | |
| Certificate of Analysis | Dec 10, 2025 | M339846 | |
| Certificate of Analysis | Dec 10, 2025 | M339846 | |
| Certificate of Analysis | Mar 10, 2025 | M339846 | |
| Certificate of Analysis | Mar 10, 2025 | M339846 | |
| Certificate of Analysis | Mar 10, 2025 | M339846 | |
| Certificate of Analysis | Mar 10, 2025 | M339846 | |
| Certificate of Analysis | Mar 08, 2024 | M339846 | |
| Certificate of Analysis | Feb 05, 2024 | M339846 | |
| Certificate of Analysis | Feb 05, 2024 | M339846 | |
| Certificate of Analysis | Feb 05, 2024 | M339846 | |
| Certificate of Analysis | Feb 05, 2024 | M339846 | |
| Certificate of Analysis | Feb 05, 2024 | M339846 | |
| Certificate of Analysis | Feb 05, 2024 | M339846 | |
| Certificate of Analysis | Feb 05, 2024 | M339846 | |
| Certificate of Analysis | Feb 05, 2024 | M339846 | |
| Certificate of Analysis | Feb 05, 2024 | M339846 | |
| Certificate of Analysis | Jan 05, 2023 | M339846 | |
| Certificate of Analysis | Jan 05, 2023 | M339846 | |
| Certificate of Analysis | Jan 05, 2023 | M339846 | |
| Certificate of Analysis | Jan 05, 2023 | M339846 | |
| Certificate of Analysis | Jan 05, 2023 | M339846 | |
| Certificate of Analysis | Jan 05, 2023 | M339846 | |
| Certificate of Analysis | Jan 05, 2023 | M339846 |
| Solubilité | Slightly soluble in water, slightly soluble in methanol, ethanol and DMSO, insoluble in chloroform and acetone |
|---|---|
| Sensibilité | Light and heat sensitive |
| Indice de réfraction | n20D1.71 |
| Point d'ébullition (°C) | ~805.7° C at 760 mmHg (Predicted) |
| Point de fusion (°C) | 170-174° C |
| Poids moléculaire | 444.500 g/mol |
| XLogP3 | 1.000 |
| Hydrogen Bond Donor Count | 8 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 12 |
| Exact Mass | 444.201 Da |
| Monoisotopic Mass | 444.201 Da |
| Topological Polar Surface Area | 163.000 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 571.000 |
| 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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