paramethadione - Moligand™ , Voltage-gated T-type calcium channel blocker, CAS No.115-67-3, Voltage-gated T-type calcium channel blocker

CAS: 115-67-3 Cat. No.: P612624 Fórmula: C₇H₁₁NO₃ Peso molecular: 157.17 Número CE: 204-098-8 PubChem CID: 8280

GRADE & PURITY Moligand™

Synonyms

Isoethadione | NSC-760129 | 4-27-00-03255 (Beilstein Handbook Reference) | D00495 | 2-Nitro-3-hydroxybenzoic acid | N03AC01 | SR-05000002060 | C07411 | Q3895202 | HMS3264I11 | PARAMETHADIONE [MART.] | HSDB 3245 | Paradione | CHEBI:7921 | EN300-255078 | Pa

Storage

Room temperature

Specifications

Sinónimos

Isoethadione | NSC-760129 | 4-27-00-03255 (Beilstein Handbook Reference) | D00495 | 2-Nitro-3-hydroxybenzoic acid | N03AC01 | SR-05000002060 | C07411 | Q3895202 | HMS3264I11 | PARAMETHADIONE [MART.] | HSDB 3245 | Paradione | CHEBI:7921 | EN300-255078 | Pa

Especificações e pureza

Moligand™

Condições de armazenamento de armazenamento

Room temperature

Grau

Moligand™

Tipo de ação

BLOCKER

Mecanismo de ação

Voltage-gated T-type calcium channel blocker

Propriedades do produto

• ALogP: 0.8

Nomes e identificadores

• Sorrisos canónicos: CCC1(C(=O)N(C(=O)O1)C)C
• IUPAC Name: 5-ethyl-3,5-dimethyl-1,3-oxazolidine-2,4-dione
• InChIKey: VQASKUSHBVDKGU-UHFFFAOYSA-N
• INCHI: 1S/C7H11NO3/c1-4-7(2)5(9)8(3)6(10)11-7/h4H2,1-3H3
• SMILES isoméricas: CCC1(C(=O)N(C(=O)O1)C)C
• PubChem CID: 8280
• Peso molecular: 157.17

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Azolidines
      • Subclass Oxazolidines
        • Level5 Oxazolidinones
          • Level6 Oxazolidinediones

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Azolidines
• Subclass: Oxazolidines
• Intermediate Tree Nodes: Oxazolidinones
• Direct Parent: Oxazolidinediones
• Alternative Parents: Dicarboximides Carbamate esters Organic carbonic acids and derivatives Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Oxazolidinedione - Dicarboximide - Carbamic acid ester - Carbonic acid derivative - Oxacycle - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Aliphatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as oxazolidinediones. These are compounds containing an oxazolidine ring which bears two ketones.
• External Descriptors: oxazolidinone

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

Mecanismos de ação

Propriedades químicas e físicas

• Peso molecular: 157.170 g/mol
• XLogP3: 0.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 157.074 Da
• Monoisotopic Mass: 157.074 Da
• Topological Polar Surface Area: 46.600 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 214.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Perguntas frequentes

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 room temperature.

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

The CAS Number is 115-67-3, the molecular formula is C7H11NO3, and the molecular weight is 157.17 g/mol. InChIKey VQASKUSHBVDKGU-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.