Apcin - ≥98%(HPLC) , CAS No.300815-04-7

CAS: 300815-04-7 Cat. No.: A288130 Molecular Weight: 438.65 EC Number: 853-640-5
AVAILABLE TO ORDER
GRADE & PURITY ≥98%(HPLC)
Synonyms
Apcin | BDBM50527906 | 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl N-{2,2,2-trichloro-1-[(pyrimidin-2-yl)amino]ethyl}carbamate | EN300-105883 | AKOS040759454 | 2-(2-methyl-5-nitroimidazol-1-yl)ethyl N-[2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl]carbamate
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
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Size
Status
Price
Qty
5mg
A288130-5mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$86.90

$130.90
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10mg
A288130-10mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$142.90

$214.90
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25mg
A288130-25mg
2

$197.90

$296.90
Save $99.00 (33.34%)
50mg
A288130-50mg
2

$251.90

$377.90
Save $126.00 (33.34%)
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Why this grade

≥98%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at -20°C Ships Ice chest + Ice pads 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
Apcin | BDBM50527906 | 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl N-{2, 2, 2-trichloro-1-[(pyrimidin-2-yl)amino]ethyl}carbamate | EN300-105883 | AKOS040759454 | 2-(2-methyl-5-nitroimidazol-1-yl)ethyl N-[2, 2, 2-trichloro-1-(pyrimidin-2-ylamino)ethyl]carbamate
Specifications & Purity
≥98%(HPLC)
Biochemical and Physiological Mechanisms
Cdc20 inhibitor; inhibits Cdc20-substrate interaction. Blocks substrate-mediated Cdc20 loading onto the anaphase-promoting complex (APC). Inhibits APC-dependent ubiquitylation. Prolongs mitotic duration in RPE1 cells in combination with proTAME (prodrug o
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥98%(HPLC)
Names and Identifiers
Pubchem Sid504762224
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504762224
Canonical SmilesCC1=NC=C(N1CCOC(=O)NC(C(Cl)(Cl)Cl)NC2=NC=CC=N2)[N+](=O)[O-]
IUPAC Name2-(2-methyl-5-nitroimidazol-1-yl)ethyl N-[2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl]carbamate
InChIKeyZEXHXVOGJFGTRX-UHFFFAOYSA-N
INCHI1S/C13H14Cl3N7O4/c1-8-19-7-9(23(25)26)22(8)5-6-27-12(24)21-10(13(14,15)16)20-11-17-3-2-4-18-11/h2-4,7,10H,5-6H2,1H3,(H,21,24)(H,17,18,20)
Isomeric SMILES CC1=NC=C(N1CCOC(=O)NC(C(Cl)(Cl)Cl)NC2=NC=CC=N2)[N+](=O)[O-]
Molecular Weight 438.65
Reaxy-Rn 18639708
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=18639708&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.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassAzoles
SubclassImidazoles
Intermediate Tree Nodes Substituted imidazoles
Direct ParentNitroimidazoles
Alternative Parents 1,2,5-trisubstituted imidazoles  Nitroaromatic compounds  Secondary alkylarylamines  Pyrimidines and pyrimidine derivatives  N-substituted imidazoles  Carbamate esters  Heteroaromatic compounds  Organic carbonic acids and derivatives  Propargyl-type 1,3-dipolar organic compounds  Azacyclic compounds  Organic oxoazanium compounds  Hydrocarbon derivatives  Organic oxides  Carbonyl compounds  Organic zwitterions  Organochlorides  Alkyl chlorides  Organopnictogen compounds  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents 1,2,5-trisubstituted-imidazole - Nitroaromatic compound - Nitroimidazole - Trisubstituted imidazole - Secondary aliphatic/aromatic amine - N-substituted imidazole - Pyrimidine - Heteroaromatic compound - Carbamic acid ester - C-nitro compound - Organic nitro compound - Carbonic acid derivative - Azacycle - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Allyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Organochloride - Alkyl halide - Organohalogen compound - Alkyl chloride - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organopnictogen compound - Carbonyl group - Organic zwitterion - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as nitroimidazoles. These are compounds containing an imidazole ring which bears a nitro group.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
A-375 (9258 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MCF7 (126967 Activities)
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MDA-MB-468 (9477 Activities)
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OVCAR-3 (48710 Activities)
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A549 (127892 Activities)
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Caov-3 cell line (328 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HepG2 (196354 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HeLa (62764 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MDA-MB-231 (73002 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.

4 results found

Lot NumberCertificate TypeDateItem
J2112119Certificate of AnalysisJul 19, 2024 A288130
J2112120Certificate of AnalysisJul 19, 2024 A288130
J2112121Certificate of AnalysisJul 19, 2024 A288130
J2112122Certificate of AnalysisJul 19, 2024 A288130
Chemical and Physical Properties
SolubilitySolvent:DMSO, Max Conc. mg/mL: 43.87, Max Conc. mM: 100
Molecular Weight438.600 g/mol
XLogP33.000
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count7
Exact Mass437.017 Da
Monoisotopic Mass437.017 Da
Topological Polar Surface Area140.000 Ų
Heavy Atom Count27
Formal Charge0
Complexity513.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
Reviews

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