N-Benzyl-5-bromonicotinamide - ≥96% , CAS No.303031-43-8

CAS: 303031-43-8 Cat. No.: N183544 Molecular Weight: 291.14
AVAILABLE TO ORDER
GRADE & PURITY ≥96%
Synonyms
Oprea1_086436 | CTVYYGDKDNYJPO-UHFFFAOYSA-N | 5-bromo-N-(phenylmethyl)pyridine-3-carboxamide | HMS2529C03 | 5-bromo-N-(phenylmethyl)-3-pyridinecarboxamide | MLS000704043 | BDBM66487 | SCHEMBL1558714 | N-Benzyl-5-bromonicatinamide | MFCD01788380 | N-benzyl
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
N183544-1g
7

$29.90

$44.90
Save $15.00 (33.41%)
5g
N183544-5g
1

$42.90

$64.90
Save $22.00 (33.90%)
25g
N183544-25g
1

$213.90

$320.90
Save $107.00 (33.34%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥96% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal 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

Synonyms
Oprea1_086436 | CTVYYGDKDNYJPO-UHFFFAOYSA-N | 5-bromo-N-(phenylmethyl)pyridine-3-carboxamide | HMS2529C03 | 5-bromo-N-(phenylmethyl)-3-pyridinecarboxamide | MLS000704043 | BDBM66487 | SCHEMBL1558714 | N-Benzyl-5-bromonicatinamide | MFCD01788380 | N-benzyl
Specifications & Purity
≥96%
Storage
Room temperature
Shipped In
Normal
Purity
≥96%
Names and Identifiers
Pubchem Sid504760252
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504760252
Canonical SmilesC1=CC=C(C=C1)CNC(=O)C2=CC(=CN=C2)Br
IUPAC NameN-benzyl-5-bromopyridine-3-carboxamide
InChIKeyCTVYYGDKDNYJPO-UHFFFAOYSA-N
INCHI1S/C13H11BrN2O/c14-12-6-11(8-15-9-12)13(17)16-7-10-4-2-1-3-5-10/h1-6,8-9H,7H2,(H,16,17)
Isomeric SMILES C1=CC=C(C=C1)CNC(=O)C2=CC(=CN=C2)Br
Molecular Weight 291.14
Reaxy-Rn 19927453
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=19927453&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.

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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
SuperclassOrganoheterocyclic compounds
ClassPyridines and derivatives
SubclassPyridinecarboxylic acids and derivatives
Intermediate Tree Nodes Pyridinecarboxamides
Direct ParentNicotinamides
Alternative Parents Benzene and substituted derivatives  Aryl bromides  Heteroaromatic compounds  Secondary carboxylic acid amides  Azacyclic compounds  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Organobromides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Nicotinamide - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as nicotinamides. These are heterocyclic aromatic compounds containing a pyridine ring substituted at position 3 by a carboxamide group.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
PTPN7 Tchem Protein-tyrosine phosphatase LC-PTP (886 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PTPN22 Tchem Hematopoietic cell protein-tyrosine phosphatase 70Z-PEP (1215 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SMN1 Tchem Survival motor neuron protein (34246 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CBX1 Tbio Chromobox protein homolog 1 (92434 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Plasmodium falciparum (966862 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:

Find and download the COA for your product by matching the lot number on the packaging.

2 results found

Lot NumberCertificate TypeDateItem
J2226053Certificate of AnalysisAug 11, 2025 N183544
K1907144Certificate of AnalysisJun 16, 2025 N183544
Chemical and Physical Properties
Molecular Weight291.140 g/mol
XLogP32.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass290.005 Da
Monoisotopic Mass290.005 Da
Topological Polar Surface Area42.000 Ų
Heavy Atom Count17
Formal Charge0
Complexity254.000
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 Count1
Solution Calculators
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