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

ACCESS ALL DATA
Browse all information
CHEMISTRY
Discover Molecule Insights

FINISHED DOSAGE FORMULATIONS

16 FDF Dossiers, 16 FDA Orange Book

16 FDF Dossiers
16 FDA Orange Book

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: 80495-46-1, Mezlocillin sodium monohydrate [orange book], 3cww8b5904, Baycipen, Baypen, Mezlocillin sodium (jan)

Molecular Formula

C₂₁H₂₆N₅NaO₉S₂

Molecular Weight

579.6 g/mol

InChI Key

CZXDIDROKIDGNE-SYNJJEHYSA-M

FDA UNII

3CWW8B5904

Semisynthetic ampicillin-derived acylureido penicillin. It has been proposed for infections with certain anaerobes and may be useful in inner ear, bile, and CNS infections.

1 2D Structure

Mezlocillin Sodium Monohydrate

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

sodium;(2S,5R,6R)-3,3-dimethyl-6-[[(2R)-2-[(3-methylsulfonyl-2-oxoimidazolidine-1-carbonyl)amino]-2-phenylacetyl]amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;hydrate

2.1.2 InChI

InChI=1S/C21H25N5O8S2.Na.H2O/c1-21(2)14(18(29)30)26-16(28)13(17(26)35-21)22-15(27)12(11-7-5-4-6-8-11)23-19(31)24-9-10-25(20(24)32)36(3,33)34;;/h4-8,12-14,17H,9-10H2,1-3H3,(H,22,27)(H,23,31)(H,29,30);;1H2/q;+1;/p-1/t12-,13-,14+,17-;;/m1../s1

2.1.3 InChI Key

CZXDIDROKIDGNE-SYNJJEHYSA-M

2.1.4 Canonical SMILES

CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)NC(=O)N4CCN(C4=O)S(=O)(=O)C)C(=O)[O-])C.O.[Na+]

2.1.5 Isomeric SMILES

CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)NC(=O)N4CCN(C4=O)S(=O)(=O)C)C(=O)[O-])C.O.[Na+]

2.2 Other Identifiers

2.2.1 UNII

3CWW8B5904

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Bay F 1353

2. Bay-f 1353

3. Bayf 1353

4. Baypen

5. Melocin

6. Meslocillin

7. Mezlin

8. Mezlocillin

9. Mezlocillin Sodium

10. Mezlocilline

11. Sodium, Mezlocillin

2.3.2 Depositor-Supplied Synonyms

1. 80495-46-1

2. Mezlocillin Sodium Monohydrate [orange Book]

3. 3cww8b5904

4. Baycipen

5. Baypen

6. Mezlocillin Sodium (jan)

7. 4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic Acid, 3,3-dimethyl-6-(((2r)-(((3-(methylsulfonyl)-2-oxo-1-imidazolidinyl)carbonyl)amino)phenylacetyl)amino)-7-oxo-, Monosodium Salt, Monohydrate, (2s,5r,6r)-

8. Sodium (2s,5r,6r)-3,3-dimethyl-6-((r)-2-(3-(methylsulfonyl)-2-oxo-1-imidazolidinecarboxamido)-2-phenylacetamido)-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate, Monohydrate

9. Mezlocillin Sodium [jan]

10. Unii-3cww8b5904

11. Mezlin (tn)

12. Schembl1237585

13. Chebi:52068

14. 4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic Acid, 3,3-dimethyl-6-(((((3-(methylsulfonyl)-2-oxo-1-imidazolidinyl)carbonyl)amino)phenylacetyl)amino)-7-oxo-, Monosodium Salt, Monohydrate (2s-(2alpha,5alpha,6beta(s*)))-

15. Mezlocillin Sodium Salt Monohydrate

16. D02221

17. Mezlocillin Sodium Monohydrate [who-dd]

18. Mezlocillin Sodium Salt Monohydrate [mi]

19. Q27123146

20. 4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic Acid, 3,3-dimethyl-6-(((((3-(methylsulfonyl)-2-oxo-1-imidazolidinyl)carbonyl)amino)phenylacetyl)amino)-7-oxo-, Monosodium Salt, Monohydrate (2s-(2.alpha.,5.alpha.,6.beta.(s*)))-

21. Sodium (2s,5r,6r)-3,3-dimethyl-6-{[(2r)-2-({[3-(methylsulfonyl)-2-oxoimidazolidin-1-yl]carbonyl}amino)-2-phenylacetyl]amino}-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Hydrate

22. Sodium 6beta-{(2r)-2-[3-(methanesulfonyl)-2-oxoimidazolidine-1-carboxamido]-2-phenylacetamido}-2,2-dimethylpenam-3alpha-carboxylate--water (1/1)

23. Sodium 6beta-{(2r)-2-[3-(methanesulfonyl)-2-oxoimidazolidine-1-carboxamido]-2-phenylacetamido}penicillanate Hydrate

2.4 Create Date

2008-02-05

3 Chemical and Physical Properties

Molecular Formula	C₂₁H₂₆N₅NaO₉S₂
Molecular Weight	579.6 g/mol
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	6
Exact Mass	579.10696405 g/mol
Monoisotopic Mass	579.10696405 g/mol
Topological Polar Surface Area	211 Å²
Heavy Atom Count	38
Formal Charge	0
Complexity	1090
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	3