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224,000+ 研究の概要 · Triple ISO certified · COA & SDS すべての製品に適用 · 在庫品は当日出荷

LIT-001 - Moligand™ , Agonist of OT receptor;Agonist of V 1A receptor;Agonist of V 2 receptor, CAS No.2245072-20-0, Agonist of OT receptor;Agonist of V 1A receptor;Agonist of V 2 receptor

CAS: 2245072-20-0 Cat. No.: L611546 PubChem CID: 145711714
COA
LIT-001 - Moligand™ , Agonist of OT receptor;Agonist of V 1A receptor;Agonist of V 2 receptor, CAS No.2245072-20-0, Agonist of OT receptor;Agonist of V 1A receptor;Agonist of V 2 receptor
注文可能
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
Synonyms
compound 57;LIT001
Storage
Room temperature
★
Size
USA
ドイツ (EU)*
Price
Qty
5mg
L611546-5mg
受注生産 · 8～12週間

$1,142.90

$1,334.90
保存 $192.00 (14.38%)
25mg
L611546-25mg
受注生産 · 8～12週間

$1,714.90

$2,001.90
保存 $287.00 (14.34%)
Enter a quantity for the sizes you want to add.
Bulk / Custom
♡ ウィッシュリスト ⇅ 比較リストに入れる ⎙ Print page
SDS
Safety data
COA
Certificate
DS
Datasheet
SP
Spec sheet
Specifications 名前と識別子 Documentation Advanced Data Taxonomic Classification 3 D構造 関連ターゲット（人間） 作用メカニズム 証明書（CoA、COO、BSE/TSEと分析図） 化学的性質と物理的性質 ソリューション計算機 レビュー
🧪
Why this grade

Moligand™ Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships 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
compound 57;LIT001
仕様と純度
Moligand™
保管条件
Room temperature
等級
Moligand™
アクションタイプ
AGONIST
作用メカニズム
Agonist of OT receptor;Agonist of V 1A receptor;Agonist of V 2 receptor
名前と識別子
カノニカル・スマイル
Cc1c(ccc(c1)C(=O)N1Cc2c(Nc3ccccc13)n(nc2)C)CNC(=O)N1CCC[C@H]1C(=S)N(C)C
IUPAC Name
(2S)-2-(dimethylcarbamothioyl)-N-[[2-methyl-4-(1-methyl-4,10-dihydropyrazolo[4,3-c][1,5]benzodiazepine-5-carbonyl)phenyl]methyl]pyrrolidine-1-carboxamide
InChIKey
AOPORIRPXVMWSL-DEOSSOPVSA-N
INCHI
1S/C28H33N7O2S/c1-18-14-19(11-12-20(18)15-29-28(37)34-13-7-10-24(34)27(38)32(2)3)26(36)35-17-21-16-30-33(4)25(21)31-22-8-5-6-9-23(22)35/h5-6,8-9,11-12,14,16,24,31H,7,10,13,15,17H2,1-4H3,(H,29,37)/t24-/m0/s1
異性体SMILES
CC1=C(C=CC(=C1)C(=O)N2CC3=C(NC4=CC=CC=C42)N(N=C3)C)CNC(=O)N5CCC[C@H]5C(=S)N(C)C
PubChem CID
145711714

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
SuperclassOrganoheterocyclic compounds
分類Benzodiazepines
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentBenzodiazepines
Alternative Parents Benzamides  Pyrrolidinecarboxamides  Benzoyl derivatives  1,4-diazepines  Thioamides  Tertiary carboxylic acid amides  Heteroaromatic compounds  Azoles  Organic carbonic acids and derivatives  Amino acids and derivatives  Thiocarboxylic acid amides  Secondary amines  Azacyclic compounds  Organopnictogen compounds  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Benzodiazepine - Benzoic acid or derivatives - Benzamide - Pyrrolidine-1-carboxamide - Pyrrolidine carboxylic acid or derivatives - Benzoyl - Para-diazepine - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Thioamide - Tertiary carboxylic acid amide - Pyrrolidine - Azole - Carbonic acid derivative - Carboxamide group - Amino acid or derivatives - Azacycle - Thiocarboxylic acid amide - Secondary amine - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Aromatic heteropolycyclic compound
説明This compound belongs to the class of organic compounds known as benzodiazepines. These are organic compounds containing a benzene ring fused to either isomers of diazepine(unsaturated seven-member heterocycle with two nitrogen atoms replacing two carbon atoms).
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）
AVPR1A Tclin Vasopressin V1a receptor (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
AVPR2 Tclin Vasopressin V2 receptor (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
OXTR Tclin Oxytocin receptor (3 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
AVPR2 Tclin Vasopressin V2 receptor (2912 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
OXTR Tclin Oxytocin receptor (1962 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
AVPR1A Tclin Vasopressin V1a receptor (5412 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
AVPR1B Tclin Vasopressin V1b receptor (1301 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
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
分子量531.700 g/mol
XLogP32.800
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass531.242 Da
Monoisotopic Mass531.242 Da
Topological Polar Surface Area118.000 Ų
Heavy Atom Count38
Formal Charge0
Complexity887.000
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
ソリューション計算機
レビュー

顧客レビュー

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View related series

Class A GPCR (8086) OT receptor Agonist (12) V1A receptor Agonist (20) V2 receptor Agonist (21)
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