H 151 - Moligand™, 10mM in DMSO , Antagonist of stimulator of interferon response cGAMP interactor 1, CAS No.941987-60-6, Antagonist of stimulator of interferon response cGAMP interactor 1

CAS: 941987-60-6 Cat. No.: H427016 Formula: C₁₇H₁₇N₃O Molecular Weight: 279.34 EC Number: 845-509-6

GRADE & PURITY Moligand™, 10mM in DMSO

Synonyms

941987-60-6|1-(4-ethylphenyl)-3-(1H-indol-3-yl)urea|H-151|H 151|N-(4-ethylphenyl)-N'-1H-indol-3-yl-urea|MFCD08026581|H151|CS-0062722|STING antagonist|3-(4-ethylphenyl)-1-(1H-indol-3-yl)urea|H151 pound>>H 151|CHEMBL5179819|SCHEMBL21484988|GTPL10122|BCP2996

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Specifications

Synonyms

941987-60-6 | 1-(4-ethylphenyl)-3-(1H-indol-3-yl)urea | H-151 | H 151 | N-(4-ethylphenyl)-N'-1H-indol-3-yl-urea | MFCD08026581 | H151 | CS-0062722 | STING antagonist | 3-(4-ethylphenyl)-1-(1H-indol-3-yl)urea | H151 pound>>H 151 | CHEMBL5179819 | SCHEMBL21484988 | GTPL10122 | BCP2996

Specifications & Purity

Moligand™, 10mM in DMSO

Biochemical and Physiological Mechanisms

H-151 is an irreversible antagonist of the stimulator of interferon genes (STING) protein, a central signalling component of the cytosolic DNA sensing pathway. Although STING is a vital component of the innate immune pathways, it has also been shown to ha

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

This product requires cold chain shipping. Ground and other economy services are not available.

Grade

Moligand™

Action Type

ANTAGONIST

Mechanism of action

Antagonist of stimulator of interferon response cGAMP interactor 1

Names and Identifiers

Pubchem Sid

528764772

Canonical Smiles

CCC1=CC=C(C=C1)NC(=O)NC2=CNC3=CC=CC=C32

IUPAC Name

1-(4-ethylphenyl)-3-(1H-indol-3-yl)urea

InChIKey

UJZDIKVQFMCLBE-UHFFFAOYSA-N

INCHI

1S/C17H17N3O/c1-2-12-7-9-13(10-8-12)19-17(21)20-16-11-18-15-6-4-3-5-14(15)16/h3-11,18H,2H2,1H3,(H2,19,20,21)

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)NC2=CNC3=CC=CC=C32

Molecular Weight

279.34

Reaxy-Rn

33196081

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=33196081&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass N-phenylureas

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: N-phenylureas
• Intermediate Tree Nodes: Not available
• Direct Parent: N-phenylureas
• Alternative Parents: Indoles Substituted pyrroles Heteroaromatic compounds Ureas Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: N-phenylurea - Indole - Indole or derivatives - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Urea - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as n-phenylureas. These are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea group.
• 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.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

TMEM173 Tchem Stimulator of interferon genes protein (0 Activities)

Discover Target: TMEM173

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

HFF (3142 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

MEF (1005 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Molecular Weight: 279.340 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 279.137 Da
• Monoisotopic Mass: 279.137 Da
• Topological Polar Surface Area: 56.900 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 352.000
• 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