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· · COA & SDS available for every product · Same-day shipping on in-stock items RIPK2 inhibitor 3 - Moligand™ , CAS No.R613199
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. Synonyms
MFCD30489430 | [2-({4-[(1,3-benzothiazol-5-yl)amino]-6-(2-methylpropane-2-sulfonyl)quinazolin-7-yl}oxy)ethoxy]phosphonic acid | GSK2983559 (compound 3) | SCHEMBL15578200 | RIPK2 inhibitor 3 | BCP23871 | 1579965-12-0 | 2-[4-(1,3-benzothiazol-5-ylamino)-6-~
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Why this grade Moligand™ Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
MFCD30489430 | [2-({4-[(1, 3-benzothiazol-5-yl)amino]-6-(2-methylpropane-2-sulfonyl)quinazolin-7-yl}oxy)ethoxy]phosphonic acid | GSK2983559 (compound 3) | SCHEMBL15578200 | RIPK2 inhibitor 3 | BCP23871 | 1579965-12-0 | 2-[4-(1, 3-benzothiazol-5-ylamino)-6-~
Specifications & Purity
Moligand™
Names and Identifiers Canonical Smiles OP(=O)(OCCOc1cc2ncnc(c2cc1S(=O)(=O)C(C)(C)C)Nc1ccc2c(c1)ncs2)O IUPAC Name 2-[4-(1,3-benzothiazol-5-ylamino)-6-tert-butylsulfonylquinazolin-7-yl]oxyethyl dihydrogen phosphate InChIKey MJLYDVMFNHZMLV-UHFFFAOYSA-N INCHI 1S/C21H23N4O7PS2/c1-21(2,3)35(29,30)19-9-14-15(10-17(19)31-6-7-32-33(26,27)28)22-11-23-20(14)25-13-4-5-18-16(8-13)24-12-34-18/h4-5,8-12H,6-7H2,1-3H3,(H,22,23,25)(H2,26,27,28) Isomeric SMILES CC(C)(C)S(=O)(=O)C1=C(C=C2C(=C1)C(=NC=N2)NC3=CC4=C(C=C3)SC=N4)OCCOP(=O)(O)O PubChem CID 73386708
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organoheterocyclic compounds Class Diazanaphthalenes Subclass Benzodiazines Intermediate Tree Nodes Quinazolines Direct Parent Quinazolinamines Alternative Parents Benzothiazoles Phenol ethers Monoalkyl phosphates Aminopyrimidines and derivatives Alkyl aryl ethers Imidolactams Thiazoles Sulfones Heteroaromatic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Amines Molecular Framework Aromatic heteropolycyclic compounds Substituents Quinazolinamine - 1,3-benzothiazole - Phenol ether - Alkyl aryl ether - Aminopyrimidine - Monoalkyl phosphate - Organic phosphoric acid derivative - Phosphoric acid ester - Pyrimidine - Alkyl phosphate - Benzenoid - Imidolactam - Sulfone - Heteroaromatic compound - Sulfonyl - Thiazole - Azole - Ether - Azacycle - Organic oxygen compound - Amine - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic compound Description 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 Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 538.500 g/mol XLogP3 2.300 Hydrogen Bond Donor Count 3 Hydrogen Bond Acceptor Count 12 Rotatable Bond Count 9 Exact Mass 538.075 Da Monoisotopic Mass 538.075 Da Topological Polar Surface Area 197.000 Ų Heavy Atom Count 35 Formal Charge 0 Complexity 878.000 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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