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Chemistry

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Also known as: 95761-91-4, Cefotiam hexetil ester, Cefotiam hexetil hydrochloride, Pansporin t, Chebi:59211, J92a81y99t
Molecular Formula
C27H37N9O7S3
Molecular Weight
695.8  g/mol
InChI Key
VVFDMWZLBPUKTD-ZKRNHDOASA-N
FDA UNII
J92A81Y99T

Cefotiam Hexetil
Cefotiam Hexetil Hydrochloride is the hydrochloride salt of cefotiam hexetil, an ester prodrug of cefotiam for parenteral use. Cefotiam is a semi-synthetic, beta-lactam cephalosporin antibiotic with antibacterial activity. After administration of cefotiam hexetil hydrochloride the ester bond is cleaved, releasing active cefotiam.
1 2D Structure

Cefotiam Hexetil

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-cyclohexyloxycarbonyloxyethyl (6R,7R)-7-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]-3-[[1-[2-(dimethylamino)ethyl]tetrazol-5-yl]sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
2.1.2 InChI
InChI=1S/C27H37N9O7S3/c1-15(42-27(40)43-18-7-5-4-6-8-18)41-24(39)21-16(13-46-26-31-32-33-35(26)10-9-34(2)3)12-44-23-20(22(38)36(21)23)30-19(37)11-17-14-45-25(28)29-17/h14-15,18,20,23H,4-13H2,1-3H3,(H2,28,29)(H,30,37)/t15?,20-,23-/m1/s1
2.1.3 InChI Key
VVFDMWZLBPUKTD-ZKRNHDOASA-N
2.1.4 Canonical SMILES
CC(OC(=O)C1=C(CSC2N1C(=O)C2NC(=O)CC3=CSC(=N3)N)CSC4=NN=NN4CCN(C)C)OC(=O)OC5CCCCC5
2.1.5 Isomeric SMILES
CC(OC(=O)C1=C(CS[C@H]2N1C(=O)[C@H]2NC(=O)CC3=CSC(=N3)N)CSC4=NN=NN4CCN(C)C)OC(=O)OC5CCCCC5
2.2 Other Identifiers
2.2.1 UNII
J92A81Y99T
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Cefotiam Hexetil Hydrochloride

2. Cefotiam Hexetil, (6r-(3(r*),6alpha,7beta))-isomer

3. Cefotiam Hexetil, (6r-(3(s*),6alpha,7beta))-isomer

4. Cefotiam Hexetil, (6r-(6alpha,7beta))-isomer

2.3.2 Depositor-Supplied Synonyms

1. 95761-91-4

2. Cefotiam Hexetil Ester

3. Cefotiam Hexetil Hydrochloride

4. Pansporin T

5. Chebi:59211

6. J92a81y99t

7. Sce 2174

8. 95789-30-3

9. Cefotiam 1-(cyclohexyloxycarbonyloxy)ethyl Ester

10. 1-cyclohexyloxycarbonyloxyethyl (6r,7r)-7-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]-3-[[1-[2-(dimethylamino)ethyl]tetrazol-5-yl]sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

11. 1-{[(cyclohexyloxy)carbonyl]oxy}ethyl (6r,7r)-7-{[(2-amino-1,3-thiazol-4-yl)acetyl]amino}-3-[({1-[2-(dimethylamino)ethyl]-1h-tetrazol-5-yl}sulfanyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

12. 1-{[(cyclohexyloxy)carbonyl]oxy}ethyl 7beta-(2-amino-1,3-thiazol-4-yl)acetamido-3-[({1-[2-(dimethylamino)ethyl]-1h-tetrazol-5-yl}sulfanyl)methyl]-3,4-didehydrocepham-4-carboxylate

13. 5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic Acid, 7-[[(2-amino-4-thiazolyl)acetyl]amino]-3-[[[1-[2-(dimethylamino)ethyl]-1h-tetrazol-5-yl]thio]methyl]-8-oxo-, 1-[[(cyclohexyloxy)carbonyl]oxy]ethyl Ester, (6r,7r)-

14. Sce-2174

15. Unii-j92a81y99t

16. Cefotiam Cilexetil

17. Cefotiamhexetilester

18. 5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic Acid, 7-(((2-amino-4-thiazolyl)acetyl)amino)-3-(((1-(2-(dimethylamino)ethyl)-1h-tetrazol-5-yl)thio)methyl)-8-oxo-, 1-(((cyclohexyloxy)carbonyl)oxy)ethyl Ester, (6r,7r)-

19. Schembl193201

20. Chembl3137675

21. Dtxsid20914817

22. Ncgc00483046-01

23. A900158

24. Q27126537

25. 5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic Acid, 7-(((2-amino-4-thiazolyl)acetyl)amino)-3-(((1-(2-(dimethylamino)ethyl)-1h-tetrazol-5-yl)thio)methyl)-8-oxo-, 1-(((cyclohexyloxy)carbonyl)oxy)ethyl Ester, (6r-(6alpha,7beta))-

26. 5-thia-1-azabicyclo[4.2.0]oct-2-ene-2- Carboxylic Acid,7-[[(2-amino-4-thiazolyl)- Acetyl]amino]-3-[[[1-[2-(dimethylamino)- Ethyl]-1h-tetrazol-5-yl]thio]methyl]-8-oxo-,1-[[(cyclohexyloxy)carbonyl]oxy]ethyl Ester,dihydrochloride,(6r,7r)-

27. N-{2-[(1-{[(cyclohexyloxy)carbonyl]oxy}ethoxy)carbonyl]-3-[({1-[2-(dimethylamino)ethyl]-1h-tetrazol-5-yl}sulfanyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl}-2-(2-imino-2,3-dihydro-1,3-thiazol-4-yl)ethanimidic Acid

2.4 Create Date
2005-06-24
3 Chemical and Physical Properties
Molecular Weight 695.8 g/mol
Molecular Formula C27H37N9O7S3
XLogP32.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count16
Rotatable Bond Count16
Exact Mass695.19780807 g/mol
Monoisotopic Mass695.19780807 g/mol
Topological Polar Surface Area276 Ų
Heavy Atom Count46
Formal Charge0
Complexity1160
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Anti-Bacterial Agents

Substances that inhibit the growth or reproduction of BACTERIA. (See all compounds classified as Anti-Bacterial Agents.)


ABOUT THIS PAGE

Cefotiam Hexetil Manufacturers

A Cefotiam Hexetil manufacturer is defined as any person or entity involved in the manufacture, preparation, processing, compounding or propagation of Cefotiam Hexetil, including repackagers and relabelers. The FDA regulates Cefotiam Hexetil manufacturers to ensure that their products comply with relevant laws and regulations and are safe and effective to use. Cefotiam Hexetil API Manufacturers are required to adhere to Good Manufacturing Practices (GMP) to ensure that their products are consistently manufactured to meet established quality criteria.

Cefotiam Hexetil Suppliers

A Cefotiam Hexetil supplier is an individual or a company that provides Cefotiam Hexetil active pharmaceutical ingredient (API) or Cefotiam Hexetil finished formulations upon request. The Cefotiam Hexetil suppliers may include Cefotiam Hexetil API manufacturers, exporters, distributors and traders.

Cefotiam Hexetil GMP

Cefotiam Hexetil Active pharmaceutical ingredient (API) is produced in GMP-certified manufacturing facility.

GMP stands for Good Manufacturing Practices, which is a system used in the pharmaceutical industry to make sure that goods are regularly produced and monitored in accordance with quality standards. The FDA’s current Good Manufacturing Practices requirements are referred to as cGMP or current GMP which indicates that the company follows the most recent GMP specifications. The World Health Organization (WHO) has its own set of GMP guidelines, called the WHO GMP. Different countries can also set their own guidelines for GMP like China (Chinese GMP) or the EU (EU GMP).

PharmaCompass offers a list of Cefotiam Hexetil GMP manufacturers, exporters & distributors, which can be sorted by USDMF, JDMF, KDMF, CEP (COS), WC, API price, and more, enabling you to easily find the right Cefotiam Hexetil GMP manufacturer or Cefotiam Hexetil GMP API supplier for your needs.

Cefotiam Hexetil CoA

A Cefotiam Hexetil CoA (Certificate of Analysis) is a formal document that attests to Cefotiam Hexetil's compliance with Cefotiam Hexetil specifications and serves as a tool for batch-level quality control.

Cefotiam Hexetil CoA mostly includes findings from lab analyses of a specific batch. For each Cefotiam Hexetil CoA document that a company creates, the USFDA specifies specific requirements, such as supplier information, material identification, transportation data, evidence of conformity and signature data.

Cefotiam Hexetil may be tested according to a variety of international standards, such as European Pharmacopoeia (Cefotiam Hexetil EP), Cefotiam Hexetil JP (Japanese Pharmacopeia) and the US Pharmacopoeia (Cefotiam Hexetil USP).

Inform the supplier about your product requirements, specifying if you need a product with particular monograph like EP (Ph. Eur.), USP, JP, BP, or any other quality. In addition, clarify whether you need hydrochloride (HCl), anhydricum, base, micronisatum or a specific level of purity. To find reputable suppliers, utilize the filters and select those certified by GMP, FDA, or any other certification as per your requirement.
For your convenience, we have listed synonyms and CAS numbers to help you find the best supplier. The use of synonyms and CAS numbers can be helpful in identifying potential suppliers, but it is crucial to note that they might not always indicate the exact same product. It is important to confirm the product details with the supplier before making a purchase to ensure that it meets your requirements.
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