benzatropine - Moligand™ , Inhibitor of B⁰AT1;Inhibitor of DAT;Antagonist of M 1 receptor;Antagonist of M 2 receptor, CAS No.86-13-5, Inhibitor of B⁰AT1;Inhibitor of DAT;Antagonist of M 1 receptor;Antagonist of M 2 receptor

CAS: 86-13-5 Cat. No.: B607990
Disponível para encomenda
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
8-Azabicyclo(3.2.1)octane, 3-(diphenylmethoxy)-8-methyl-, endo- | Tox21_111303 | (1R,3r,5S)-3-(Diphenylmethoxy)-8-methyl-8-azabicyclo[3.2.1]octane | AB01566865_01 | benztropine-mesylate | DTXCID502659 | EN300-6492989 | 3alpha-benzhydryloxy-8-methyl-8-azab
Storage
Room temperature
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Size
Alemanha (EU)
USA*
Price
Qty
5mg
B607990-5mg
Sob encomenda · 8–12 semanas
694,10€
25mg
B607990-25mg
Sob encomenda · 8–12 semanas
1041,20€
Enter a quantity for the sizes you want to add.
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Why this grade

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

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Storage & shipping

Room temperature Ships Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
8-Azabicyclo(3.2.1)octane, 3-(diphenylmethoxy)-8-methyl-, endo- | Tox21_111303 | (1R,3r,5S)-3-(Diphenylmethoxy)-8-methyl-8-azabicyclo[3.2.1]octane | AB01566865_01 | benztropine-mesylate | DTXCID502659 | EN300-6492989 | 3alpha-benzhydryloxy-8-methyl-8-azab
Especificações e pureza
Moligand™
Condições de armazenamento de armazenamento
Room temperature
Grau
Moligand™
Tipo de ação
ANTAGONIST, INHIBITOR
Mecanismo de ação
Inhibitor of B⁰AT1;Inhibitor of DAT;Antagonist of M 1 receptor;Antagonist of M 2 receptor
Nomes e identificadores
Sorrisos canónicos
CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1
IUPAC Name
(1R,5S)-3-[di(phenyl)methoxy]-8-methyl-8-azabicyclo[3.2.1]octane
InChIKey
GIJXKZJWITVLHI-PMOLBWCYSA-N
INCHI
1S/C21H25NO/c1-22-18-12-13-19(22)15-20(14-18)23-21(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,18-21H,12-15H2,1H3/t18-,19+,20+
SMILES isoméricas
CN1[C@@H]2CC[C@H]1CC(C2)OC(C3=CC=CC=C3)C4=CC=CC=C4
Reaxy-Rn
19029226
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=19029226&ln=

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

Estrutura 3D
Modelo de Estrutura Química Interativa





Alvos associados (humanos)
SLC6A19 Tchem Sodium-dependent neutral amino acid transporter B(0)AT1 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
SLC6A3 Tclin Sodium-dependent dopamine transporter (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
CHRM2 Tclin Muscarinic acetylcholine receptor M2 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
CHRM1 Tclin Muscarinic acetylcholine receptor M1 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
Certificados(CoA,COO,BSE/TSE e Mapa de Análise)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propriedades químicas e físicas
Peso molecular307.400 g/mol
XLogP34.500
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass307.194 Da
Monoisotopic Mass307.194 Da
Topological Polar Surface Area12.500 Ų
Heavy Atom Count23
Formal Charge0
Complexity340.000
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculadoras de soluções
Revisões

Avaliações dos Clientes

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