Avibactam
Also known as Nxl-104 free acid, [(2S,5R)-2-carbamoyl-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate, Zavicefta component avibactam
Key facts
What buyers check first
- CAS number
- 1192500-31-4
- Formula
- C7H11N3O6S
- Molar mass
- 265.25 g/mol
- HS code
- 293399
- Category
- Antibiotics and anti-infectives
What is Avibactam?
Plain description, key identifiers and synonyms
Avibactam is a member of the class of azabicycloalkanes that is (2S,5R)-7-oxo-1,6-diazabicyclo[3.2.1]octane-2-carboxamide in which the amino hydrogen at position 6 is replaced by a sulfooxy group. Used (in the form of its sodium salt) in combination with ceftazidime pentahydrate for the treatment of complicated urinary tract infections including pyelonephritis. It has a role as an antimicrobial agent, an EC 3.5.2.6 (beta-lactamase) inhibitor and an antibacterial drug. It is a monocarboxylic acid amide, a hydroxylamine O-sulfonic acid, an azabicycloalkane and a member of ureas. It is a conjugate acid of an avibactam(1-).
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- [(2S,5R)-2-carbamoyl-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate
- CAS number
- 1192500-31-4 CAS number cross-checkedOther or deprecated CAS: 1192651-79-8, 1416134-69-4, 396731-14-9, 794508-22-8
- Molecular formula
- C7H11N3O6S
- UNII
- 06MFO7817I, 7352665165
- InChIKey
- NDCUAPJVLWFHHB-UHNVWZDZSA-N
- InChI
- InChI=1S/C7H11N3O6S/c8-6(11)5-2-1-4-3-9(5)7(12)10(4)16-17(13,14)15/h4-5H,1-3H2,(H2,8,11)(H,13,14,15)/t4-,5+/m1/s1
- Canonical SMILES
- NC(=O)C1CCC2CN1C(=O)N2OS(=O)(=O)O
- Isomeric SMILES
- C1C[C@H](N2C[C@@H]1N(C2=O)OS(=O)(=O)O)C(=O)N
Synonyms
- Nxl-104 free acid
- [(2S,5R)-2-carbamoyl-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate
- Zavicefta component avibactam
- [(2S,5R)-2-Carbamoyl-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl]oxidanesulfonic acid
- avibactamum
- ((2S,5R)-2-carbamoyl-7-oxo-1,6-diazabicyclo(3.2.1)octan-6-yl) hydrogen sulfate
- ((2S,5R)-2-carbamoyl-7-oxo-1,6-diazabicyclo(3.2.1)octan-6-yl)oxidanesulfonic acid
- Avibactam free acid
- AVE-1330A free acid
- Avibactam (free acid)
- (1R,2S,5R)-2-carbamoyl-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl hydrogen sulfate
- (2S,5R)-7-oxo-6-(sulfooxy)-1,6-diazabicyclo[3.2.1]octane-2-carboxamide
- 1,6-Diazabicyclo(3.2.1)octane-2-carboxamide, 7-oxo-6-(sulfooxy)-, (1R,2S,5R)-rel-
- (2S,5R)-2-carbamoyl-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl hydrogen sulfate
- Sulfuric acid, mono[(1R,2S,5R)-2-(aminocarbonyl)-7-oxo-1,6-diazabicyclo[3.2.1]oct-6-yl] ester
- Avibactamfreeacid
- FYG
- Avibactam Impurity 02
- Avibactam, (+/-)-
- AVI
- trans-7-oxo-6-(sulfooxy)-1,6-diazabicyclo[3.2.1]octan-2-carboxamide
- (1R,2S,5R)-7-Oxo-6-sulfooxy-1,6-diazabicyclo(3.2.1)octane-2-carboxamide
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 265.25 g/molcalc.Computed value |
|---|---|
| Exact mass | 265.0369 Dacalc.Computed value |
| LogP (octanol/water) | -1.53calc.Computed value |
| Topological polar surface area | 130.2 Ųcalc.Computed value |
| Hydrogen bond donors | 2calc.Computed value |
| Hydrogen bond acceptors | 5calc.Computed value |
| Rotatable bonds | 3calc.Computed value |
| Heavy atoms | 17calc.Computed value |
| Rings | 2calc.Computed value |
| Aromatic rings | 0calc.Computed value |
| Fraction sp3 carbons | 0.71calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 2calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
O=C1NC2CCCN1C2
2 rings, 9 atoms, the 1,6-Diazabicyclo[3.2.1]octan-7-one ring system.
35 other chemicals share this scaffoldSafety and hazards
GHS classification summary, not a safety data sheet
No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Avibactam suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- India, Chennai ManufacturerUnclaimed profileAvibactamGrade, purity and minimum order on requestPrice on request
- China, TianjinUnclaimed profileAvibactamGrade, purity and minimum order on requestPrice on request
- ChinaUnclaimed profileAvibactamGrade, purity and minimum order on requestPrice on request
- Price on request
- China, ChengduUnclaimed profileAvibactamGrade, purity and minimum order on requestPrice on request
- China, Cangzhou ManufacturerUnclaimed profileAvibactamGrade, purity and minimum order on requestPrice on request
- United States, HopkintonUnclaimed profileAvibactamGrade, purity and minimum order on requestPrice on request
Suppliers marked Unclaimed profile have not claimed their profile yet. They are not verified by CompoundList, their offers are price on request and details may have changed, so please confirm them with the supplier. Company representatives can claim a profile with a business email on the company's own website domain. Our team verifies each claim and sends the result by email.
Where suppliers are based
8 suppliers in 3 countries
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Avibactam price
Indicative price range per kg from live supplier offers
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Uses and applications
What the substance is used for, by industry and function
Industries and functions
Pharmacological actions
- beta-Lactamase Inhibitors
Roles
- antibacterial agent
- antibacterial drug
- antiinfective agent
- antimicrobial agent
- antimicrobial drug
- enzyme inhibitor
- pharmaceutical
Pharmacology
Avibactam is a beta Lactamase Inhibitor. The mechanism of action of avibactam is as a beta Lactamase Inhibitor.
Regulatory status
Inventories, regulations and trade controls that list this substance
No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Avibactam is traded under.
Heterocyclic compounds with nitrogen hetero-atom(s) only, other
- Slovenia31.7%
- Italy24.2%
- United States5.0%
* Partner reported figures, a lower bound.
The HS code shown for Avibactam is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Avibactam, based on the data on this page
What is Avibactam?
What is the CAS number of Avibactam?
What is the molecular formula and weight of Avibactam?
What is Avibactam used for?
Is Avibactam hazardous?
What is the HS code of Avibactam?
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Where can I buy Avibactam in India?
What is the price of Avibactam?
Guides for buyers
Practical guides that help when you source, ship or handle Avibactam
- Article, QualityPharma grades explained: IP vs BP vs USP vs EPWhat the Indian, British, US and European pharmacopoeias are, how their monographs differ, what multi grade claims mean and why a grade alone does not make a product fit for medicines.Read
- Article, SourcingHow to write an RFQ that gets fast and accurate quotesWhat suppliers need to quote quickly and comparably: exact product identity, quantity and packing, delivery terms, documents, samples and payment, with a ready to use template.Read
- Guide, Trade and logisticsHS codes for chemicals and why they matterHow the Harmonized System classifies chemicals, the chapters that matter, the rules for chemically defined compounds and mixtures, and practical steps to find the right code.Read
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