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

COA

Grade & Purity:

Moligand™

Cas Number: 115-67-3
Molecular Weight: 157.17
PubChem CID: 8280

In stock

Item Number

P612624

Grouped product items
SKU	Size	Availability	Price	Qty
P612624-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,000.90
P612624-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,000.90

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Ion channel (2197)

Basic Description

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
Specifications & Purity	Moligand™
Grade	Moligand™
Action Type	BLOCKER
Mechanism of action	Voltage-gated T-type calcium channel blocker

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Azolidines
    - Subclass Oxazolidines
      - Level5 Oxazolidinones
        Level6 Oxazolidinediones

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	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
Description	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
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

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	5-ethyl-3,5-dimethyl-1,3-oxazolidine-2,4-dione
INCHI	InChI=1S/C7H11NO3/c1-4-7(2)5(9)8(3)6(10)11-7/h4H2,1-3H3
InChIKey	VQASKUSHBVDKGU-UHFFFAOYSA-N
Smiles	CCC1(C(=O)N(C(=O)O1)C)C
Isomeric SMILES	CCC1(C(=O)N(C(=O)O1)C)C
PubChem CID	8280
Molecular Weight	157.17

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	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 Å²
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

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