Apcin - 10mM in DMSO , CAS No.300815-04-7

CAS: 300815-04-7 Cat. No.: A423090 Molecular Weight: 438.65 EC Number: 853-640-5
AVAILABLE TO ORDER
GRADE & PURITY 10mM in DMSO
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 -80°C
Shipped In
Dry ice packs + Cold packs
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Size
Status
Price
Qty
1ml
A423090-1ml
2

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Why this grade

10mM in DMSO for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at -80°C Ships Dry ice packs + Cold packs 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
10mM in DMSO
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 -80°C
Shipped In
Dry ice packs + Cold packs
This product requires cold chain shipping. Ground and other economy services are not available.
Action Type
INHIBITOR
Names and Identifiers
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.

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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
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





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MDA-MB-231 (73002 Activities)
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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 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
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