1H-Imidazole-4-carboxamide, 1-((1R,2S)-2-hydroxy-1-(2-(1-naphthalenyl)ethyl)propyl)- , CAS No.256461-79-7

CAS: 256461-79-7 Cat. No.: H668292 Molecular Weight: 323.4 PubChem CID: 449013
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Synonyms
FR-234938 | UNII-10302WQ21V | (+)-FR-234938 | 10302WQ21V | 1H-Imidazole-4-carboxamide, 1-((1R,2S)-2-hydroxy-1-(2-(1-naphthalenyl)ethyl)propyl)- | FR234938 | 1-((3R,4S)-4-hydroxy-1-(naphthalen-1-yl)pentan-3-yl)-1H-imidazole-4-carboxamide | 1-[(1R,2S)-2-hyd
Storage
Room temperature
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Size
Status
Price
Qty
1mg
H668292-1mg
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$571.90

$999.90
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5mg
H668292-5mg
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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
FR-234938 | UNII-10302WQ21V | (+)-FR-234938 | 10302WQ21V | 1H-Imidazole-4-carboxamide, 1-((1R, 2S)-2-hydroxy-1-(2-(1-naphthalenyl)ethyl)propyl)- | FR234938 | 1-((3R, 4S)-4-hydroxy-1-(naphthalen-1-yl)pentan-3-yl)-1H-imidazole-4-carboxamide | 1-[(1R, 2S)-2-hyd
Storage
Room temperature
Action Type
INHIBITOR
Product Properties
ALogP2.5
Names and Identifiers
Canonical SmilesCC(C(CCC1=CC=CC2=CC=CC=C21)N3C=C(N=C3)C(=O)N)O
IUPAC Name1-[(3R,4S)-4-hydroxy-1-naphthalen-1-ylpentan-3-yl]imidazole-4-carboxamide
InChIKeyOODDZQQDDOVCFD-SCLBCKFNSA-N
INCHI1S/C19H21N3O2/c1-13(23)18(22-11-17(19(20)24)21-12-22)10-9-15-7-4-6-14-5-2-3-8-16(14)15/h2-8,11-13,18,23H,9-10H2,1H3,(H2,20,24)/t13-,18+/m0/s1
Isomeric SMILES C[C@@H]([C@@H](CCC1=CC=CC2=CC=CC=C21)N3C=C(N=C3)C(=O)N)O
PubChem CID 449013
Molecular Weight 323.4

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

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✅ 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
ClassNaphthalenes
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentNaphthalenes
Alternative Parents 2-heteroaryl carboxamides  Carbonylimidazoles  N-substituted imidazoles  Vinylogous amides  Heteroaromatic compounds  Secondary alcohols  Primary carboxylic acid amides  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Naphthalene - 2-heteroaryl carboxamide - Imidazole-4-carbonyl group - N-substituted imidazole - Azole - Imidazole - Heteroaromatic compound - Vinylogous amide - Carboxamide group - Primary carboxylic acid amide - Secondary alcohol - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Alcohol - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
ADA Tclin Adenosine deaminase (2 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
ADA Tclin Adenosine deaminase (129 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Canis familiaris (36305 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 Weight323.400 g/mol
XLogP32.500
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass323.163 Da
Monoisotopic Mass323.163 Da
Topological Polar Surface Area81.100 Ų
Heavy Atom Count24
Formal Charge0
Complexity431.000
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
Solution Calculators
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