CCR2 antagonist 3 - ≥98% , CAS No.1380100-86-6

CAS: 1380100-86-6 Cat. No.: C647230 분자식: C17H25FN2O2 분자량: 308.39 PubChem CID: 57345449
주문 가능
GRADE & PURITY ≥98%
Synonyms
GTPL7704 | SCHEMBL9106608 | AZD 2927 | 4-fluoro-N-[(2S)-1-(3-hydroxyazetidin-1-yl)-3-methylbutan-2-yl]-N,3-dimethylbenzamide | MS-24474 | Benzamide, 4-fluoro-N-[(1S)-1-[(3-hydroxy-1-azetidinyl)methyl]-2-methylpropyl]-N,3-dimethyl- | AZD 2927 [WHO-DD] | CC
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
★
Size
USA
독일 (EU)*
Price
Qty
5mg
C647230-5mg
주문제작 · 8~12주
US$800.90
10mg
C647230-10mg
주문제작 · 8~12주
US$1,360.90
25mg
C647230-25mg
주문제작 · 8~12주
US$2,700.90
50mg
C647230-50mg
주문제작 · 8~12주
US$4,400.90
100mg
C647230-100mg
주문제작 · 8~12주
US$6,800.90
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥98% 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.

개요

CCR2 antagonist 3 is a chemokine receptor 2 (CCR2) antagonist.

Form:Solid

IC50& Target:CCR2

Specifications

동의어
GTPL7704 | SCHEMBL9106608 | AZD 2927 | 4-fluoro-N-[(2S)-1-(3-hydroxyazetidin-1-yl)-3-methylbutan-2-yl]-N,3-dimethylbenzamide | MS-24474 | Benzamide, 4-fluoro-N-[(1S)-1-[(3-hydroxy-1-azetidinyl)methyl]-2-methylpropyl]-N,3-dimethyl- | AZD 2927 [WHO-DD] | CC
사양 및 순도
≥98%
생화학 및 생리적 메커니즘
CCR2 antagonist 3 is a chemokine receptor 2 (CCR2) antagonist.
보관 조건
Store at -20°C
배송
Ice chest + Ice pads
이 제품은 콜드 체인 배송이 필요합니다.지상 및 기타 경제 서비스는 사용할 수 없습니다.
작업 유형
ANTAGONIST
순수함
≥98%
이름과 식별자
정식 스마일
CC1=C(C=CC(=C1)C(=O)N(C)C(CN2CC(C2)O)C(C)C)F
IUPAC Name
4-fluoro-N-[(2S)-1-(3-hydroxyazetidin-1-yl)-3-methylbutan-2-yl]-N,3-dimethylbenzamide
InChIKey
GAHPWXLXWUVMIV-MRXNPFEDSA-N
INCHI
1S/C17H25FN2O2/c1-11(2)16(10-20-8-14(21)9-20)19(4)17(22)13-5-6-15(18)12(3)7-13/h5-7,11,14,16,21H,8-10H2,1-4H3/t16-/m1/s1
이성체 SMILES
CC1=C(C=CC(=C1)C(=O)N(C)[C@H](CN2CC(C2)O)C(C)C)F
대체 CAS
1380100-86-6
PubChem CID
57345449
MeSH 용어
4-fluoro-N-(1-(3-hydroxyazetidin-1-yl)-3-methylbutan-2-yl)-N,3-dimethylbenzamide;AZD2927
분자량
308.39

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
SuperclassBenzenoids
분류Benzene and substituted derivatives
SubclassToluenes
Intermediate Tree Nodes Toluamides - m-Toluamides
Direct ParentN,N-dialkyl-m-toluamides
Alternative Parents 4-halobenzoic acids and derivatives  Benzamides  Benzoyl derivatives  Fluorobenzenes  Aryl fluorides  Tertiary carboxylic acid amides  Trialkylamines  Secondary alcohols  Azetidines  Amino acids and derivatives  1,2-aminoalcohols  Azacyclic compounds  Organofluorides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents N,n-dialkyl-m-toluamide - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Tertiary carboxylic acid amide - Tertiary amine - Secondary alcohol - Tertiary aliphatic amine - Amino acid or derivatives - Azetidine - 1,2-aminoalcohol - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Alcohol - Organohalogen compound - Organofluoride - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Amine - Organooxygen compound - Aromatic heteromonocyclic compound
설명This compound belongs to the class of organic compounds known as n,n-dialkyl-m-toluamides. These are aromatic that contain a m-toluamide, where the carboxamide group is N- substituted with two alkyl chains.
External Descriptors Not available
3D 구조
상호 작용 화학 구조 모델





관련 대상(인간)
KCNJ3 Tchem G protein-activated inward rectifier potassium channel 1 (0 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
KCNJ5 Tchem G protein-activated inward rectifier potassium channel 4 (0 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
인증서(CoA, COO, BSE/TSE 및 분석 차트)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
화학 및 물리적 특성
용해성DMSO : 100 mg/mL (324.26 mM; Need ultrasonic)
분자량308.400 g/mol
XLogP32.400
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass308.19 Da
Monoisotopic Mass308.19 Da
Topological Polar Surface Area43.800 Ų
Heavy Atom Count22
Formal Charge0
Complexity385.000
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
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