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

CAS: 145196-87-8 Cat. No.: I287222 分子式: C15H19IN4S•2HBr 分子量: 576.13 PubChem CID: 24978528
注文可能
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
ドイツ (EU)*
Price
Qty
10mg
I287222-10mg
受注生産 · 8~12週間
$373.90
50mg
I287222-50mg
受注生産 · 8~12週間
$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

同義語
N-[2-(4-Iodophenyl)ethyl]-S-[3-(4(5)-imidazolyl)propyl]isothiourea dihydrobromide
仕様と純度
≥98%(HPLC)
生化学的・生理学的メカニズム
Selective H3antagonist with high affinity (KD= 0.3 nM).
保管条件
Store at 2-8°C,Desiccated
入荷
Wet ice
この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。
純度
≥98%(HPLC)
名前と識別子
カノニカル・スマイル
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
異性体SMILES
C1=CC(=CC=C1CCN=C(N)SCCCC2=CN=CN2)I.Br.Br
PubChem CID
24978528
分子量
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
分類Benzene 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
説明This 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
3 D構造
インタラクティブ化学構造モデル





関連ターゲット(人間)
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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
関連ターゲット(非人間)
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作用メカニズム
証明書(CoA、COO、BSE/TSEと分析図)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
化学的性質と物理的性質
溶解度Solvent:water, Max Conc. mg/mL: 14.4, Max Conc. mM: 25
分子量576.100 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
ソリューション計算機
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