N-(3-Carbamoyl-phenyl)-succinamic acid , CAS No.74182-38-0

CAS: 74182-38-0 Cat. No.: N668445 Molecular Weight: 236.22 PubChem CID: 722008
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Synonyms
3-[(3-carbamoylphenyl)carbamoyl]propanoic acid | 4-((3-Carbamoylphenyl)amino)-4-oxobutanoic acid | 4-[(3-carbamoylphenyl)amino]-4-oxobutanoic acid | N-(3-Carbamoyl-phenyl)-succinamic acid | 4-(3-carbamoylanilino)-4-oxobutanoic acid | CBMicro_016742 | Camb
Storage
Room temperature
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Status
Price
Qty
1mg
N668445-1mg
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$571.90

$999.90
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5mg
N668445-5mg
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$1,999.90

$2,999.90
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Why this grade

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

Synonyms
3-[(3-carbamoylphenyl)carbamoyl]propanoic acid | 4-((3-Carbamoylphenyl)amino)-4-oxobutanoic acid | 4-[(3-carbamoylphenyl)amino]-4-oxobutanoic acid | N-(3-Carbamoyl-phenyl)-succinamic acid | 4-(3-carbamoylanilino)-4-oxobutanoic acid | CBMicro_016742 | Camb
Storage
Room temperature
Product Properties
ALogP0.1
Names and Identifiers
Canonical SmilesC1=CC(=CC(=C1)NC(=O)CCC(=O)O)C(=O)N
IUPAC Name4-(3-carbamoylanilino)-4-oxobutanoic acid
InChIKeyIQDYBIOBYSQBQY-UHFFFAOYSA-N
INCHI1S/C11H12N2O4/c12-11(17)7-2-1-3-8(6-7)13-9(14)4-5-10(15)16/h1-3,6H,4-5H2,(H2,12,17)(H,13,14)(H,15,16)
Isomeric SMILES C1=CC(=CC(=C1)NC(=O)CCC(=O)O)C(=O)N
PubChem CID 722008
Molecular Weight 236.22

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.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassBenzoic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentAcylaminobenzoic acid and derivatives
Alternative Parents Benzamides  Anilides  N-arylamides  Benzoyl derivatives  Fatty amides  Secondary carboxylic acid amides  Primary carboxylic acid amides  Monocarboxylic acids and derivatives  Carboxylic acids  Organopnictogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Acylaminobenzoic acid or derivatives - Benzamide - Anilide - Benzoyl - N-arylamide - Fatty amide - Fatty acyl - Carboxamide group - Primary carboxylic acid amide - Secondary carboxylic acid amide - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
PARP1 Tclin Poly [ADP-ribose] polymerase 1 (2 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
PARP1 Tclin Poly [ADP-ribose] polymerase-1 (6206 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PARP14 Tchem Poly [ADP-ribose] polymerase 14 (380 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PARP15 Tchem Poly [ADP-ribose] polymerase 15 (178 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
Molecular Weight236.220 g/mol
XLogP30.100
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass236.08 Da
Monoisotopic Mass236.08 Da
Topological Polar Surface Area109.000 Ų
Heavy Atom Count17
Formal Charge0
Complexity317.000
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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