Iodophenpropit dihydrobromide - ≥98%(HPLC) , CAS No.145196-87-8

CAS: 145196-87-8 Cat. No.: I287222 분자식: C15H19IN4S•2HBr 분자량: 576.13 PubChem CID: 24978528
주문 가능
GRADE & PURITY ≥98%(HPLC)
Synonyms
N-[2-(4-Iodophenyl)ethyl]-S-[3-(4(5)-imidazolyl)propyl]isothiourea dihydrobromide
Storage
Store at 2-8°C,Desiccated
Shipped In
Wet ice
★
Size
USA
독일 (EU)*
Price
Qty
10mg
I287222-10mg
주문제작 · 8~12주
US$373.90
50mg
I287222-50mg
주문제작 · 8~12주
US$1,565.90
Enter a quantity for the sizes you want to add.
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Why this grade

≥98%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Desiccated Ships Wet ice 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.

Specifications

동의어
N-[2-(4-Iodophenyl)ethyl]-S-[3-(4(5)-imidazolyl)propyl]isothiourea dihydrobromide
사양 및 순도
≥98%(HPLC)
생화학 및 생리적 메커니즘
Selective H3antagonist with high affinity (KD= 0.3 nM).
보관 조건
Store at 2-8°C,Desiccated
배송
Wet ice
이 제품은 콜드 체인 배송이 필요합니다.지상 및 기타 경제 서비스는 사용할 수 없습니다.
순수함
≥98%(HPLC)
이름과 식별자
정식 스마일
C1=CC(=CC=C1CCN=C(N)SCCCC2=CN=CN2)I.Br.Br
IUPAC Name
3-(1H-imidazol-5-yl)propyl N'-[2-(4-iodophenyl)ethyl]carbamimidothioate;dihydrobromide
InChIKey
BOSOGNBLIWPCMS-UHFFFAOYSA-N
INCHI
1S/C15H19IN4S.2BrH/c16-13-5-3-12(4-6-13)7-8-19-15(17)21-9-1-2-14-10-18-11-20-14;;/h3-6,10-11H,1-2,7-9H2,(H2,17,19)(H,18,20);2*1H
이성체 SMILES
C1=CC(=CC=C1CCN=C(N)SCCCC2=CN=CN2)I.Br.Br
PubChem CID
24978528
분자량
576.13

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
SubclassHalobenzenes
Intermediate Tree Nodes Not available
Direct ParentIodobenzenes
Alternative Parents Aryl iodides  Imidazoles  Heteroaromatic compounds  Isothioureas  Sulfenyl compounds  Propargyl-type 1,3-dipolar organic compounds  Carboximidamides  Azacyclic compounds  Organopnictogen compounds  Organoiodides  Hydrocarbon derivatives  Hydrobromides  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Iodobenzene - Aryl halide - Aryl iodide - Azole - Heteroaromatic compound - Imidazole - Isothiourea - Azacycle - Organoheterocyclic compound - Carboximidamide - Sulfenyl compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoiodide - Organohalogen compound - Organic nitrogen compound - Organonitrogen compound - Organosulfur compound - Organopnictogen compound - Hydrocarbon derivative - Hydrobromide - Aromatic heteromonocyclic compound
설명This compound belongs to the class of organic compounds known as iodobenzenes. These are aromatic compounds containing one or more iodine atoms attached to a benzene.
External Descriptors Not available
3D 구조
상호 작용 화학 구조 모델





관련 대상(인간)
HRH4 Tchem Histamine H4 receptor (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
HRH3 Tclin Histamine H3 receptor (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
HRH3 Tclin Histamine H3 receptor (10389 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
관련 대상(비인간)
Hrh4 Histamine H4 receptor (388 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
작용 메커니즘
인증서(CoA, COO, BSE/TSE 및 분석 차트)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
화학 및 물리적 특성
용해성Solvent:water, Max Conc. mg/mL: 14.4, Max Conc. mM: 25
분자량576.100 g/mol
XLogP3
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Exact Mass575.888 Da
Monoisotopic Mass573.89 Da
Topological Polar Surface Area92.400 Ų
Heavy Atom Count23
Formal Charge0
Complexity319.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count3
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