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Oxybuprocaine HCl - 10mM in DMSO, high purity , Sodium channel alpha subunit blocker, CAS No.5987-82-6(DMSO), Sodium channel alpha subunit blocker
Basic Description
Synonyms
Benoxinate hydrochloride | oxybuprocaine hydrochloride | 5987-82-6 | Oxybuprocaine HCL | 2-(Diethylamino)ethyl 4-amino-3-butoxybenzoate hydrochloride | Benoxinate HCL | Cebesine | Conjuncain | Dorsacaine | Lacrimin | Novesina | Novesine | Minims Benoxinate | Opulets Benoxinate | Nov
Specifications & Purity
10mM in DMSO
Storage Temp
Store at -80°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Action Type
BLOCKER
Mechanism of action
Sodium channel alpha subunit blocker
Product Description
Oxybuprocaine HCl is a local anesthetic, which is used especially in ophthalmology and otolaryngology.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
Aminobenzoic acids and derivatives Aminophenyl ethers Phenoxy compounds Benzoyl derivatives Aniline and substituted anilines Alkyl aryl ethers Trialkylamines Carboxylic acid esters Amino acids and derivatives Monocarboxylic acids and derivatives Primary amines Organopnictogen compounds Organic oxides Organic chloride salts Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Aminobenzoic acid or derivatives - Benzoate ester - Aminophenyl ether - Phenoxy compound - Benzoyl - Phenol ether - Aniline or substituted anilines - Alkyl aryl ether - Carboxylic acid ester - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Primary amine - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Amine - Organic chloride salt - Organic oxide - Hydrocarbon derivative - Organic salt - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
hydrochloride
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.
Associated Targets(Human)
Associated Targets(non-human)
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
2-(diethylamino)ethyl 4-amino-3-butoxybenzoate;hydrochloride
INCHI
InChI=1S/C17H28N2O3.ClH/c1-4-7-11-21-16-13-14(8-9-15(16)18)17(20)22-12-10-19(5-2)6-3;/h8-9,13H,4-7,10-12,18H2,1-3H3;1H
InChIKey
PRGUDWLMFLCODA-UHFFFAOYSA-N
Smiles
CCCCOC1=C(C=CC(=C1)C(=O)OCCN(CC)CC)N.Cl
Isomeric SMILES
CCCCOC1=C(C=CC(=C1)C(=O)OCCN(CC)CC)N.Cl
WGK Germany
3
RTECS
DG1502900
Molecular Weight
344.88
Reaxy-Rn
3748200
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3748200&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
DMSO 69 mg/mL Water 69 mg/mL Ethanol 69 mg/mL
Molecular Weight
344.900 g/mol
XLogP3
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
11
Exact Mass
344.187 Da
Monoisotopic Mass
344.187 Da
Topological Polar Surface Area
64.800 Ų
Heavy Atom Count
23
Formal Charge
0
Complexity
308.000
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
2
Citations of This Product
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1 Citations