AZD7594 - Moligand™, ≥98% , Glucocorticoid receptor modulator, CAS No.1196509-60-0, Glucocorticoid receptor modulator

CAS: 1196509-60-0 Cat. No.: A412393 Molecular Weight: 606.62 EC Number: 813-330-2
AVAILABLE TO ORDER
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. ≥98%
Synonyms
GTPL9325 | 3-{5-[(1R,2S)-2-(2,2-difluoropropanamido)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)propoxy]-1H-indazol-1-yl}-N-[(3R)-oxolan-3-yl]benzamide | Velsecorat | 1196509-60-0 | SCHEMBL1456757 | BS-14536 | AKOS037648545 | US8916600, 6 | BDBM141372 | compound
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1mg
A412393-1mg
2
$73.90
5mg
A412393-5mg
2
$219.90
10mg
A412393-10mg
2
$339.90
25mg
A412393-25mg
2
$739.90
50mg
A412393-50mg
2
$1,259.90
100mg
A412393-100mg
2
$1,999.90
Enter a quantity for the sizes you want to add.
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Why this grade

Moligand™, ≥98% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

Information

AZD7594 (AZ13189620) is a potent selective nonsteroidal glucocorticoid receptor modulator with IC50 of 0.9 nM.

Specifications

Synonyms
GTPL9325 | 3-{5-[(1R, 2S)-2-(2, 2-difluoropropanamido)-1-(2, 3-dihydro-1, 4-benzodioxin-6-yl)propoxy]-1H-indazol-1-yl}-N-[(3R)-oxolan-3-yl]benzamide | Velsecorat | 1196509-60-0 | SCHEMBL1456757 | BS-14536 | AKOS037648545 | US8916600, 6 | BDBM141372 | compound
Specifications & Purity
Moligand™, ≥98%
Biochemical and Physiological Mechanisms
AZD7594 (AZ13189620) is a potent selective nonsteroidal glucocorticoid receptor modulator with IC50 of 0.9 nM.
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Grade
Moligand™
Action Type
AGONIST, MODULATOR
Mechanism of action
Glucocorticoid receptor modulator
Purity
≥98%
Product Properties
ALogP4.6
Names and Identifiers
Canonical SmilesCC(C(C1=CC2=C(C=C1)OCCO2)OC3=CC4=C(C=C3)N(N=C4)C5=CC=CC(=C5)C(=O)NC6CCOC6)NC(=O)C(C)(F)F
IUPAC Name3-[5-[(1R,2S)-2-(2,2-difluoropropanoylamino)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)propoxy]indazol-1-yl]-N-[(3R)-oxolan-3-yl]benzamide
InChIKeyZZWJKLGCDHYVMB-BWGXUDETSA-N
INCHI1S/C32H32F2N4O6/c1-19(36-31(40)32(2,33)34)29(20-6-9-27-28(16-20)43-13-12-42-27)44-25-7-8-26-22(15-25)17-35-38(26)24-5-3-4-21(14-24)30(39)37-23-10-11-41-18-23/h3-9,14-17,19,23,29H,10-13,18H2,1-2H3,(H,36,40)(H,37,39)/t19-,23+,29-/m0/s1
Isomeric SMILES C[C@@H]([C@@H](C1=CC2=C(C=C1)OCCO2)OC3=CC4=C(C=C3)N(N=C4)C5=CC=CC(=C5)C(=O)N[C@@H]6CCOC6)NC(=O)C(C)(F)F
Molecular Weight 606.62
Reaxy-Rn 26295791
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=26295791&ln=

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

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassAzoles
SubclassPyrazoles
Intermediate Tree Nodes Not available
Direct ParentPhenylpyrazoles
Alternative Parents Benzo-1,4-dioxanes  Benzamides  Indazoles  Phenol ethers  Benzoyl derivatives  Alkyl aryl ethers  Para dioxins  Oxolanes  Heteroaromatic compounds  Secondary carboxylic acid amides  Oxacyclic compounds  Azacyclic compounds  Dialkyl ethers  Carbonyl compounds  Hydrocarbon derivatives  Organic oxides  Organofluorides  Alkyl fluorides  Organonitrogen compounds  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Phenylpyrazole - Benzo-1,4-dioxane - Benzodioxane - Benzamide - Benzoic acid or derivatives - Benzopyrazole - Indazole - Phenol ether - Benzoyl - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Para-dioxin - Heteroaromatic compound - Oxolane - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Ether - Dialkyl ether - Carboxylic acid derivative - Azacycle - Organofluoride - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Alkyl fluoride - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alkyl halide - Organohalogen compound - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
NR3C1 Tclin Glucocorticoid receptor (5 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
ESR1 Tclin Estrogen receptor alpha (17718 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NR3C1 Tclin Glucocorticoid receptor (14987 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PGR Tclin Progesterone receptor (8562 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NR3C2 Tclin Mineralocorticoid receptor (2134 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
AR Tclin Androgen Receptor (11781 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ESR2 Tclin Estrogen receptor beta (9272 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Rattus norvegicus (775804 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Lung (9 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

12 results found

Lot NumberCertificate TypeDateItem
L2312257Certificate of AnalysisNov 24, 2023 A412393
L2312398Certificate of AnalysisNov 24, 2023 A412393
L2312399Certificate of AnalysisNov 24, 2023 A412393
L2312401Certificate of AnalysisNov 24, 2023 A412393
L2312402Certificate of AnalysisNov 24, 2023 A412393
L2312404Certificate of AnalysisNov 24, 2023 A412393
L2312406Certificate of AnalysisNov 24, 2023 A412393
L2312407Certificate of AnalysisNov 24, 2023 A412393
L2312408Certificate of AnalysisNov 24, 2023 A412393
L2312411Certificate of AnalysisNov 24, 2023 A412393
L2312412Certificate of AnalysisNov 24, 2023 A412393
L2312413Certificate of AnalysisNov 24, 2023 A412393

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Chemical and Physical Properties
Molecular Weight606.600 g/mol
XLogP34.600
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count9
Exact Mass606.229 Da
Monoisotopic Mass606.229 Da
Topological Polar Surface Area113.000 Ų
Heavy Atom Count44
Formal Charge0
Complexity1010.000
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
Reviews

Customer Reviews

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