RCGD 423 - 10mM in DMSO , CAS No.108237-91-8

CAS: 108237-91-8 Cat. No.: R420543 분자식: C₁₅H₁₁BrN₂S 분자량: 331.23 EC 번호: 122-809-9 PubChem CID: 4456143

GRADE & PURITY 10mM in DMSO

Synonyms

N-(4-Bromophenyl)-4-phenyl-2-thiazolamine

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Specifications

동의어

N-(4-Bromophenyl)-4-phenyl-2-thiazolamine

사양 및 순도

10mM in DMSO

생화학 및 생리적 메커니즘

gp130 modulator. Binds gp130, promotes Myc expression, increases lactate production and activates downstream JAK/STAT signaling pathways in hair follicle stem cells. Also increases articular chondrocyte activation and facilitates joint repair by regulatin

보관 조건

Store at -80°C

배송

Dry ice packs + Cold packs

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이름과 식별자

Pubchem Sid

528766864

정식 스마일

C1=CC=C(C=C1)C2=CSC(=N2)NC3=CC=C(C=C3)Br

IUPAC Name

N-(4-bromophenyl)-4-phenyl-1,3-thiazol-2-amine

InChIKey

OUFYYVAASPLOAA-UHFFFAOYSA-N

INCHI

1S/C15H11BrN2S/c16-12-6-8-13(9-7-12)17-15-18-14(10-19-15)11-4-2-1-3-5-11/h1-10H,(H,17,18)

이성체 SMILES

C1=CC=C(C=C1)C2=CSC(=N2)NC3=CC=C(C=C3)Br

PubChem CID

4456143

분자량

331.23

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Benzene and substituted derivatives
      • Subclass Aniline and substituted anilines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Benzene and substituted derivatives
• Subclass: Aniline and substituted anilines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aniline and substituted anilines
• Alternative Parents: Bromobenzenes 2,4-disubstituted thiazoles Aryl bromides 2-amino-1,3-thiazoles Heteroaromatic compounds Secondary amines Azacyclic compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Aniline or substituted anilines - 2,4-disubstituted 1,3-thiazole - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - 1,3-thiazol-2-amine - Heteroaromatic compound - Azole - Thiazole - Organoheterocyclic compound - Azacycle - Secondary amine - Organobromide - Organohalogen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as aniline and substituted anilines. These are organic compounds containing an aminobenzene moiety.
• 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

화학 및 물리적 특성

• 분자량: 331.200 g/mol
• XLogP3: 5.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 329.983 Da
• Monoisotopic Mass: 329.983 Da
• Topological Polar Surface Area: 53.200 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 275.000
• 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