SB 297006 - 10mM in DMSO , CAS No.58816-69-6

CAS: 58816-69-6 Cat. No.: S424920 Molecular Weight: 342.35 EC Number: 694-538-9 PubChem CID: 9840971
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GRADE & PURITY 10mM in DMSO
Synonyms
N-Benzoyl-4-nitroaniline ethyl ester | Ethyl (2S)-2-benzamido-3-(4-nitrophenyl)propanoate | AC-36264 | SB 297006 | AS-56057 | B6053 | BDBM50100041 | MFCD19690954 | HY-103361 | (S)-Ethyl 2-benzamido-3-(4-nitrophenyl)propanoate | EX-A2738 | (S)-2-Benzoylami
Storage
Store at -80°C
Shipped In
Dry ice packs + Cold packs
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Size
Status
Price
Qty
1ml
S424920-1ml
2

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Why this grade

10mM in DMSO for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -80°C Ships Dry ice packs + Cold packs 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.

Overview

 

Specifications

Synonyms
N-Benzoyl-4-nitroaniline ethyl ester | Ethyl (2S)-2-benzamido-3-(4-nitrophenyl)propanoate | AC-36264 | SB 297006 | AS-56057 | B6053 | BDBM50100041 | MFCD19690954 | HY-103361 | (S)-Ethyl 2-benzamido-3-(4-nitrophenyl)propanoate | EX-A2738 | (S)-2-Benzoylami
Specifications & Purity
10mM in DMSO
Biochemical and Physiological Mechanisms
Highly potent, selective CCR3 antagonist (IC 50 = 2.5 μM). Displays 250-fold selectivity for CCR3 vs . CXCR1, CXCR2, CCR1 and CCR7 receptors. Potent inhibitor of Ca 2+ mobilization induced by eotaxin, eotaxin-2 and MCP-4 in human eosinophils (IC 50 values
Storage
Store at -80°C
Shipped In
Dry ice packs + Cold packs
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers
Canonical SmilesCCOC(=O)C(CC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC=CC=C2
IUPAC Nameethyl (2S)-2-benzamido-3-(4-nitrophenyl)propanoate
InChIKeyBEZXGSZPWXRHIN-INIZCTEOSA-N
INCHI1S/C18H18N2O5/c1-2-25-18(22)16(19-17(21)14-6-4-3-5-7-14)12-13-8-10-15(11-9-13)20(23)24/h3-11,16H,2,12H2,1H3,(H,19,21)/t16-/m0/s1
Isomeric SMILES CCOC(=O)[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC=CC=C2
PubChem CID 9840971
Molecular Weight 342.35

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.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic acids and derivatives
ClassCarboxylic acids and derivatives
SubclassAmino acids, peptides, and analogues
Intermediate Tree Nodes Amino acids and derivatives - Alpha amino acids and derivatives
Direct ParentPhenylalanine and derivatives
Alternative Parents Alpha amino acid esters  Hippuric acids and derivatives  N-acyl-alpha amino acids and derivatives  Amphetamines and derivatives  Nitrobenzenes  Benzoyl derivatives  Nitroaromatic compounds  Fatty acid esters  Secondary carboxylic acid amides  Carboxylic acid esters  Monocarboxylic acids and derivatives  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Hydrocarbon derivatives  Organic salts  Organic zwitterions  Carbonyl compounds  Organonitrogen compounds  Organic oxides  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Phenylalanine or derivatives - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Amphetamine or derivatives - Benzamide - Nitrobenzene - Benzoic acid or derivatives - Nitroaromatic compound - Benzoyl - Fatty acid ester - Monocyclic benzene moiety - Benzenoid - Fatty acyl - Secondary carboxylic acid amide - Carboxamide group - Organic nitro compound - C-nitro compound - Carboxylic acid ester - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
CCR3 Tchem C-C chemokine receptor type 3 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
CCR3 Tchem C-C chemokine receptor type 3 (1666 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HepG2 (196354 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Hdac6 Histone deacetylase 6 (222 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
SensitivityHeat Sensitive
Specific Rotation[α]-86° (C=1,EtOH)
Melt Point(°C)121 °C
Molecular Weight342.300 g/mol
XLogP33.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass342.122 Da
Monoisotopic Mass342.122 Da
Topological Polar Surface Area101.000 Ų
Heavy Atom Count25
Formal Charge0
Complexity463.000
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
Solution Calculators
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