N-(furan-2-ylmethyl)-2-nitro-5-piperazin-1-ylaniline , CAS No.347310-73-0

CAS: 347310-73-0 Cat. No.: N668720 Molecular Weight: 302.33 PubChem CID: 2771419
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Synonyms
(2-Furylmethyl)(2-nitro-5-piperazin-1-ylphenyl)amine | N-(furan-2-ylmethyl)-2-nitro-5-(piperazin-1-yl)aniline | N-(furan-2-ylmethyl)-2-nitro-5-piperazin-1-ylaniline | Cambridge id 6515941 | Oprea1_672226 | MLS000681120 | HMS2554B16 | N-(2-furylmethyl)-N-(
Storage
Room temperature
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1mg
N668720-1mg
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5mg
N668720-5mg
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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
(2-Furylmethyl)(2-nitro-5-piperazin-1-ylphenyl)amine | N-(furan-2-ylmethyl)-2-nitro-5-(piperazin-1-yl)aniline | N-(furan-2-ylmethyl)-2-nitro-5-piperazin-1-ylaniline | Cambridge id 6515941 | Oprea1_672226 | MLS000681120 | HMS2554B16 | N-(2-furylmethyl)-N-(
Storage
Room temperature
Product Properties
ALogP2.3
Names and Identifiers
Canonical SmilesC1CN(CCN1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CO3
IUPAC NameN-(furan-2-ylmethyl)-2-nitro-5-piperazin-1-ylaniline
InChIKeyKDQLWCWVKPPGQU-UHFFFAOYSA-N
INCHI1S/C15H18N4O3/c20-19(21)15-4-3-12(18-7-5-16-6-8-18)10-14(15)17-11-13-2-1-9-22-13/h1-4,9-10,16-17H,5-8,11H2
Isomeric SMILES C1CN(CCN1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CO3
PubChem CID 2771419
Molecular Weight 302.33

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
SuperclassOrganoheterocyclic compounds
ClassDiazinanes
SubclassPiperazines
Intermediate Tree Nodes Not available
Direct ParentPhenylpiperazines
Alternative Parents N-arylpiperazines  Nitrobenzenes  Aniline and substituted anilines  Phenylalkylamines  Dialkylarylamines  Nitroaromatic compounds  Secondary alkylarylamines  Furans  Heteroaromatic compounds  Azacyclic compounds  Propargyl-type 1,3-dipolar organic compounds  Oxacyclic compounds  Dialkylamines  Organic oxoazanium compounds  Organic zwitterions  Organooxygen compounds  Organopnictogen compounds  Hydrocarbon derivatives  Organic oxides  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Phenylpiperazine - N-arylpiperazine - Nitrobenzene - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Phenylalkylamine - Aniline or substituted anilines - Dialkylarylamine - Secondary aliphatic/aromatic amine - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Furan - Heteroaromatic compound - C-nitro compound - Tertiary amine - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Allyl-type 1,3-dipolar organic compound - Oxacycle - Secondary amine - Secondary aliphatic amine - Organic oxoazanium - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Amine - Organic oxygen compound - Hydrocarbon derivative - Organic zwitterion - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as phenylpiperazines. These are compounds containing a phenylpiperazine skeleton, which consists of a piperazine bound to a phenyl group.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
HTR6 Tchem 5-hydroxytryptamine receptor 6 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
HTR6 Tchem Serotonin 6 (5-HT6) receptor (9749 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GAA Tclin Lysosomal alpha-glucosidase (35701 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
EHMT2 Tchem Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 (93046 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ATAD5 Tbio ATPase family AAA domain-containing protein 5 (122566 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Mapt Microtubule-associated protein tau (6 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 Weight302.330 g/mol
XLogP32.300
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass302.138 Da
Monoisotopic Mass302.138 Da
Topological Polar Surface Area86.300 Ų
Heavy Atom Count22
Formal Charge0
Complexity370.000
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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