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· · COA & SDS available for every product · Same-day shipping on in-stock items INCB13739 - Moligand™ , Inhibitor of hydroxysteroid 11-beta dehydrogenase 1, CAS No.I611054, Inhibitor of hydroxysteroid 11-beta dehydrogenase 1
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
160R8ZBH0X | HY-150701 | SCHEMBL349887 | EX-A6550 | GTPL12121 | BDBM50595161 | 2-Pyridinecarboxamide, N-methyl-5-(4-(1-(((1R)-3-oxospiro(isobenzofuran-1(3H),3'-pyrrolidin)-1'-yl)carbonyl)cyclopropyl)phenyl)- | INCB13739 | INCB-13739 | N-methyl-5-[4-[1-[(1
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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
160R8ZBH0X | HY-150701 | SCHEMBL349887 | EX-A6550 | GTPL12121 | BDBM50595161 | 2-Pyridinecarboxamide, N-methyl-5-(4-(1-(((1R)-3-oxospiro(isobenzofuran-1(3H), 3'-pyrrolidin)-1'-yl)carbonyl)cyclopropyl)phenyl)- | INCB13739 | INCB-13739 | N-methyl-5-[4-[1-[(1
Specifications & Purity
Moligand™
Mechanism of action
Inhibitor of hydroxysteroid 11-beta dehydrogenase 1
Names and Identifiers Canonical Smiles N(C)C(=O)c1ccc(cn1)c1ccc(cc1)C1(CC1)C(=O)N1CC[C@@]2(C1)OC(=O)c1c2cccc1 IUPAC Name N-methyl-5-[4-[1-[(1R)-3-oxospiro[2-benzofuran-1,3'-pyrrolidine]-1'-carbonyl]cyclopropyl]phenyl]pyridine-2-carboxamide InChIKey BDQCDIWFPIDPQU-NDEPHWFRSA-N INCHI 1S/C28H25N3O4/c1-29-24(32)23-11-8-19(16-30-23)18-6-9-20(10-7-18)27(12-13-27)26(34)31-15-14-28(17-31)22-5-3-2-4-21(22)25(33)35-28/h2-11,16H,12-15,17H2,1H3,(H,29,32)/t28-/m0/s1 Isomeric SMILES CNC(=O)C1=NC=C(C=C1)C2=CC=C(C=C2)C3(CC3)C(=O)N4CC[C@]5(C4)C6=CC=CC=C6C(=O)O5 PubChem CID 66662059
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 Pyridines and derivatives Subclass Phenylpyridines Intermediate Tree Nodes Not available Direct Parent Phenylpyridines Alternative Parents Phthalides Phenylacetamides Benzofuranones Pyridinecarboxamides Isobenzofurans 2-heteroaryl carboxamides N-acylpyrrolidines Cyclopropanecarboxylic acids and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Lactones Azacyclic compounds Oxacyclic compounds Organonitrogen compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents 3-phenylpyridine - Phenylacetamide - Phthalide - Benzofuranone - Isobenzofuranone - Pyridine carboxylic acid or derivatives - Pyridinecarboxamide - Isobenzofuran - Isocoumaran - 2-heteroaryl carboxamide - N-acylpyrrolidine - Cyclopropanecarboxylic acid or derivatives - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Pyrrolidine - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactone - Secondary carboxylic acid amide - Carboxylic acid derivative - Oxacycle - Azacycle - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Organooxygen compound - Carbonyl group - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as phenylpyridines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyridine ring through a CC or CN bond. 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 467.500 g/mol XLogP3 2.900 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 4 Exact Mass 467.185 Da Monoisotopic Mass 467.185 Da Topological Polar Surface Area 88.600 Ų Heavy Atom Count 35 Formal Charge 0 Complexity 864.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 1 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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