Clofazimine - Moligand™, ≥98% , CAS No.2030-63-9

CAS: 2030-63-9 Cat. No.: C129483 Formula: C₂₇H₂₂Cl₂N₄ Molecular Weight: 473.4 EC Number: 217-980-2

GRADE & PURITY Moligand™, ≥98%

Synonyms

BSPBio_000531 | CLOFAZIMINE [EP MONOGRAPH] | WDQPAMHFFCXSNU-KRUMMXJUSA-N | Clofazimine [USAN:USP:INN:BAN] | Phenazine, 3-(p-chloroanilino)-10-(p-chlorophenyl)-2,10-dihydro-2-(isopropylimino)- | CCG-269477 | CPD000058704 | CLOFAZIMINE [USP IMPURITY] | D959

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Clofazimine is a rhimophenazine dye, originally developed for the treatment of tuberculosis, it has both antimicrobial and antiinflammatory activity, postulated mechanisms of action include intercalation of clofazimine with bacterial DNA and increasing levels of cellular phospholipase A2.

Specifications

Synonyms

BSPBio_000531 | CLOFAZIMINE [EP MONOGRAPH] | WDQPAMHFFCXSNU-KRUMMXJUSA-N | Clofazimine [USAN:USP:INN:BAN] | Phenazine, 3-(p-chloroanilino)-10-(p-chlorophenyl)-2,10-dihydro-2-(isopropylimino)- | CCG-269477 | CPD000058704 | CLOFAZIMINE [USP IMPURITY] | D959

Specifications & Purity

Moligand™, ≥98%

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Grade

Moligand™

Action Type

INHIBITOR

Purity

≥98%

Product Properties

ALogP

7.1

Names and Identifiers

Pubchem Sid

504750608

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504750608

Canonical Smiles

CC(C)N=C1C=C2C(=NC3=CC=CC=C3N2C4=CC=C(C=C4)Cl)C=C1NC5=CC=C(C=C5)Cl

IUPAC Name

N,5-bis(4-chlorophenyl)-3-propan-2-yliminophenazin-2-amine

InChIKey

WDQPAMHFFCXSNU-UHFFFAOYSA-N

INCHI

1S/C27H22Cl2N4/c1-17(2)30-24-16-27-25(15-23(24)31-20-11-7-18(28)8-12-20)32-22-5-3-4-6-26(22)33(27)21-13-9-19(29)10-14-21/h3-17,31H,1-2H3

Isomeric SMILES

CC(C)N=C1C=C2C(=NC3=CC=CC=C3N2C4=CC=C(C=C4)Cl)C=C1NC5=CC=C(C=C5)Cl

WGK Germany

3

RTECS

SG1578000

Alternate CAS

2030-63-9

NSC Number

141046

MeSH Entry Terms

B 663;B-663;B663;Clofazimine;G 30,320;G-30,320;G30,320;Lamprene;N,5-Bis(4-chlorophenyl)-3,5-dihydro-3-((1-methylethyl)imino)-2-phenazinamine

Molecular Weight

473.4

Reaxy-Rn

8168151

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8168151&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Diazanaphthalenes
      • Subclass Benzodiazines
        • Level5 Quinoxalines
          • Level6 Phenazines and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Diazanaphthalenes
• Subclass: Benzodiazines
• Intermediate Tree Nodes: Quinoxalines
• Direct Parent: Phenazines and derivatives
• Alternative Parents: Aniline and substituted anilines Chlorobenzenes Pyrazines Aryl chlorides Secondary ketimines Heteroaromatic compounds Secondary amines Azacyclic compounds Organopnictogen compounds Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Phenazine - Aniline or substituted anilines - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrazine - Heteroaromatic compound - Secondary ketimine - Azacycle - Secondary amine - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Organopnictogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as phenazines and derivatives. These are polycyclic aromatic compounds containing a phenazine moiety, which is a linear tricyclic system that consists of a two benzene rings joined by a pyrazine ring.
• External Descriptors: phenazines - monochlorobenzenes

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Solubility: Insoluble in water; easily soluble in toluene; soluble in chloroform, dimethylformamide; slightly soluble in ether, acetone; very slightly soluble in methanol, ethanol
• Sensitivity: Light sensitive
• Melt Point(°C): 219 °C
• Molecular Weight: 473.400 g/mol
• XLogP3: 7.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 472.122 Da
• Monoisotopic Mass: 472.122 Da
• Topological Polar Surface Area: 40.000 Ų
• Heavy Atom Count: 33
• Formal Charge: 0
• Complexity: 829.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Frequently Asked Questions

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

What is Moligand??

Moligand? is one of Aladdin Scientific's premium product lines, formulated for high-purity applications across multiple workflows. Compared to standard grades in the same workflow, Moligand? products typically offer tighter specifications, more rigorous QC, and stronger lot-to-lot consistency.

How should this product be stored?

Store at ?20 °C, protected from light. The material is light-sensitive — keep it in its original opaque or amber container.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 2030-63-9, the molecular formula is C27H22Cl2N4, and the molecular weight is 473.4 g/mol. InChIKey WDQPAMHFFCXSNU-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.