SSR504734 - ≥99% , CAS No.615571-23-8

CAS: 615571-23-8 Cat. No.: S651656 Peso molecular: 433.29 PubChem CID: 9954539
Disponible para pedir
GRADE & PURITY ≥99%
Synonyms
AKOS040759642 | SSR 504734 | SSR504734 | SSR-504734 | L297UZF32G | BS162755 | MS-27734 | 2-Chloro-N-[(S)-phenyl-[(2S)-piperidin-2-yl]methyl]-3-(trifluoromethyl)benzamide;hydrochloride | E98886 | YGCZZYKACZXKHK-AKXYIILFSA-N | Compound 1549 | 2-Chloro-N-((S
Storage
Store at 2-8°C,Protected from light,Desiccated
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
5mg
S651656-5mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
1.200,90US$
10mg
S651656-10mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
2.100,90US$
Enter a quantity for the sizes you want to add.
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Why this grade

≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Protected from light,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.

Descripción general

SSR504734 is an orally active, selective and reversible inhibitor of human, rat, and mouse GlyT1 ( IC 50 =18, 15, and 38 nM, respectively). SSR504734 shows anti-schizophrenia, anti-anxiety and anti-depression activities

In Vitro

SSR504734 (15 nM-86 μM; 10 min) inhibits glycine uptake in human SK-N-MC and rat C6 cells. MCE has not independently confirmed the accuracy of these methods. They are for reference only. Cell Viability AssayCell Line: Human neuroblastoma (SK-N-MC) and rat astrocytoma (C6) cells Concentration: 15 nM-86 μM Incubation Time: 10 min Result: Showed IC 50 values of 18 and 15 nM for human SK-N-MC and rat C6 cells, respectively.

In Vivo

SSR504734 (i.p. and p.o.; 1-100 mg/kg; once) treatment shows good oral bioavailability . SSR504734 (i.p.; 30 mg/kg; once) induces a rapid and significant decrease of specific glycine uptake . SSR504734 (i.p.; 10 mg/kg; once) increases extracellular levels of Glycine in the prefrontal cortex (PFC) of freely moving rats . MCE has not independently confirmed the accuracy of these methods. They are for reference only. Animal Model: Male Sprague-Dawley rats Dosage: 1-100 mg/kg Administration: Intraperitoneal injection and oral gavage.; 1-100 mg/kg; once Result: Showed ID 50 values of 5.0 and 4.6 mg/kg for i.p. and p.o. treatments, respectively. Animal Model: Male Sprague-Dawley rats Dosage: 30 mg/kg Administration: Intraperitoneal injection; 30 mg/kg; once Result: Maintained at about 80% inhibition from 1 to 7 h after administration. Animal Model: Male Sprague-Dawley rats Dosage: 10 mg/kg Administration: Intraperitoneal injection; 10 mg/kg; once Result: Produced a rapid and sustained increase in PFC extracellular levels of glycine.

Form:Solid

IC50& Target:hGlyT1 18 nM (IC 50 ) rGlyT1 15 nM (IC 50 )

Specifications

Sinónimos
AKOS040759642 | SSR 504734 | SSR504734 | SSR-504734 | L297UZF32G | BS162755 | MS-27734 | 2-Chloro-N-[(S)-phenyl-[(2S)-piperidin-2-yl]methyl]-3-(trifluoromethyl)benzamide;hydrochloride | E98886 | YGCZZYKACZXKHK-AKXYIILFSA-N | Compound 1549 | 2-Chloro-N-((S
Especificaciones y pureza
≥99%
Mecanismos bioquímicos y fisiológicos
SSR504734 is an orally active, selective and reversible inhibitor of human, rat, and mouse GlyT1 ( IC 50 =18, 15, and 38u2009nM, respectively). SSR504734 shows anti-schizophrenia, anti-anxiety and anti-depression activities.
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C, Protected from light, Desiccated
Enviado en
Wet ice
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Pureza
≥99%
Nombres e identificadores
Sonrisas canónicasC1CCNC(C1)C(C2=CC=CC=C2)NC(=O)C3=C(C(=CC=C3)C(F)(F)F)Cl.Cl
IUPAC Name2-chloro-N-[(S)-phenyl-[(2S)-piperidin-2-yl]methyl]-3-(trifluoromethyl)benzamide;hydrochloride
InChIKeyYGCZZYKACZXKHK-AKXYIILFSA-N
INCHI1S/C20H20ClF3N2O.ClH/c21-17-14(9-6-10-15(17)20(22,23)24)19(27)26-18(13-7-2-1-3-8-13)16-11-4-5-12-25-16;/h1-3,6-10,16,18,25H,4-5,11-12H2,(H,26,27);1H/t16-,18-;/m0./s1
Isómeros SMILES C1CCN[C@@H](C1)[C@H](C2=CC=CC=C2)NC(=O)C3=C(C(=CC=C3)C(F)(F)F)Cl.Cl
CAS alternativo 615571-23-8
PubChem CID 9954539
Términos de entrada MeSH 2-chloro-N-((S)-phenyl((2S)-piperidin-2-yl)methyl)-3-trifluoromethyl benzamide;SSR504734
Peso molecular 433.29

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
ClaseBenzene and substituted derivatives
SubclassBenzoic acids and derivatives
Intermediate Tree Nodes Benzamides
Direct ParentN-benzylbenzamides
Alternative Parents Trifluoromethylbenzenes  2-halobenzoic acids and derivatives  Benzoyl derivatives  Aralkylamines  Chlorobenzenes  Piperidines  Aryl chlorides  Vinylogous halides  Secondary carboxylic acid amides  Amino acids and derivatives  Azacyclic compounds  Dialkylamines  Hydrocarbon derivatives  Hydrochlorides  Organic oxides  Organochlorides  Organofluorides  Alkyl fluorides  Organooxygen compounds  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents N-benzylbenzamide - Trifluoromethylbenzene - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Benzoyl - Chlorobenzene - Aralkylamine - Halobenzene - Aryl chloride - Aryl halide - Piperidine - Vinylogous halide - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Secondary aliphatic amine - Organoheterocyclic compound - Secondary amine - Organohalogen compound - Organic nitrogen compound - Amine - Hydrochloride - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as n-benzylbenzamides. These are compounds containing a benzamide moiety that is N-linked to a benzyl group.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
SolubilidadDMSO : 100 mg/mL (230.79 mM; Need ultrasonic)
Peso molecular433.300 g/mol
XLogP3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass432.098 Da
Monoisotopic Mass432.098 Da
Topological Polar Surface Area41.100 Ų
Heavy Atom Count28
Formal Charge0
Complexity496.000
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 Count2
Calculadoras de soluciones
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