EUROAPI, the leading small molecules API player, provides both API sales & CDMO services.

ACCESS ALL DATA
Browse all information
CHEMISTRY
Discover Molecule Insights

MARKET PLACE

1 APIs

marketPlace
1 APIs

Synopsis

ACTIVE PHARMA INGREDIENTS

API Suppliers

USDMF

CEP/COS

JDMF

EU WC

KDMF

NDC API

VMF

Listed Suppliers

API REF. PRICE (USD/KG)

$ 0

MARKET PLACE

API

FDF

0INTERMEDIATES

FINISHED DOSAGE FORMULATIONS

FDF Dossiers

FDA Orange Book

Europe

Canada

Australia

South Africa

Listed Dossiers

0 DRUGS IN DEVELOPMENT

DRUG PRODUCT COMPOSITIONS

REF. STANDARDS OR IMPURITIES

EDQM

USP

Others

PATENTS & EXCLUSIVITIES

US Patents

US Exclusivities

Health Canada Patents

DIGITAL CONTENT

Data Compilation #PharmaFlow

Stock Recap #PipelineProspector

Weekly News Recap #Phispers

News #PharmaBuzz

GLOBAL SALES INFORMATION

US Medicaid (USD)

Annual Reports (USD Million)

Finished Drug Prices

0RELATED EXCIPIENT COMPANIES

0EXCIPIENTS BY APPLICATIONS

Chemistry

Click the arrow to open the dropdown

Click the button for full data set

Also known as: 5997-53-5, 66lq48a9bt, Sodium;2-phenyl-3h-benzimidazole-5-sulfonate, 2-phenyl-1h-benzimidazole-5-sulfonic acid sodium salt, Sodium 2-phenyl-5-benzimidazolesulfonate, 1h-benzimidazole-5-sulfonic acid, 2-phenyl-, monosodium salt

Molecular Formula

C₁₃H₉N₂NaO₃S

Molecular Weight

296.28 g/mol

InChI Key

JNUBZSFXMKCDFD-UHFFFAOYSA-M

FDA UNII

66LQ48A9BT

1 2D Structure

UNII-66LQ48A9BT

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

sodium;2-phenyl-3H-benzimidazole-5-sulfonate

2.1.2 InChI

InChI=1S/C13H10N2O3S.Na/c16-19(17,18)10-6-7-11-12(8-10)15-13(14-11)9-4-2-1-3-5-9;/h1-8H,(H,14,15)(H,16,17,18);/q;+1/p-1

2.1.3 InChI Key

JNUBZSFXMKCDFD-UHFFFAOYSA-M

2.1.4 Canonical SMILES

C1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)S(=O)(=O)[O-].[Na+]

2.2 Other Identifiers

2.2.1 UNII

66LQ48A9BT

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 5997-53-5

2. 66lq48a9bt

3. Sodium;2-phenyl-3h-benzimidazole-5-sulfonate

4. 2-phenyl-1h-benzimidazole-5-sulfonic Acid Sodium Salt

5. Sodium 2-phenyl-5-benzimidazolesulfonate

6. 1h-benzimidazole-5-sulfonic Acid, 2-phenyl-, Monosodium Salt

7. Phenylbenzimidazole Sulfonic Acid Sodium Salt

8. 2-phenylbenzimidazole-5-sulfonic Acid Sodium Salt

9. Sodium 2-phenyl-1h-benzo[d]imidazole-5-sulfonate

10. 5(or 6)-benzimidazolesulfonic Acid, 2-phenyl-, Sodium Salt

11. 1h-benzimidazole-6-sulfonic Acid, 2-phenyl-, Sodium Salt (1:1)

12. Unii-66lq48a9bt

13. Ensulizole Sodium Salt

14. Schembl3173641

15. Dtxsid601021879

16. Ensulizole Sodium [who-dd]

17. Ensulizole Sodium Salt [mi]

18. Phenylbenzimidazole-5-sulfonate Sodium

19. Phenylbenzimidazole-5-sulphonate Sodium

20. 2-phenyl-5-benzimidazolsulfonate Sodium

21. Sodium Phenylbenzimidazole Sulfonate [inci]

22. Q27264002

23. Sodium 2-phenyl-1h-benzylimidazole-5-sulfonate

24. 2-phenyl-5-benzimidazolsulfonate Sodium [who-dd]

2.4 Create Date

2008-02-05

3 Chemical and Physical Properties

Molecular Formula	C₁₃H₉N₂NaO₃S
Molecular Weight	296.28 g/mol
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	296.02315761 g/mol
Monoisotopic Mass	296.02315761 g/mol
Topological Polar Surface Area	94.3 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	420
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2