MedKoo Cat#: 208450 | Name: Acebrophylline

Description:

WARNING: This product is for research use only, not for human or veterinary use.

Acebrophylline is an airway mucoregulator and anti-inflammatory agent

Chemical Structure

Acebrophylline
Acebrophylline
CAS#96989-76-3

Theoretical Analysis

MedKoo Cat#: 208450

Name: Acebrophylline

CAS#: 96989-76-3

Chemical Formula: C22H28Br2N6O5

Exact Mass: 0.0000

Molecular Weight: 616.31

Elemental Analysis: C, 42.87; H, 4.58; Br, 25.93; N, 13.64; O, 12.98

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
No Data
Synonym
Ambroxol acefyllinate
IUPAC/Chemical Name
(1r,4r)-4-((2-amino-3,5-dibromobenzyl)amino)cyclohexan-1-ol 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate
InChi Key
IPUHJDQWESJTGD-PFWPSKEQSA-N
InChi Code
InChI=1S/C13H18Br2N2O.C9H10N4O4/c14-9-5-8(13(16)12(15)6-9)7-17-10-1-3-11(18)4-2-10;1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15/h5-6,10-11,17-18H,1-4,7,16H2;4H,3H2,1-2H3,(H,14,15)/t10-,11-;
SMILES Code
OC(CN1C2=C(N(C)C(N(C)C2=O)=O)N=C1)=O.O[C@@H]3CC[C@@H](NCC4=C(N)C(Br)=CC(Br)=C4)CC3
Appearance
To be determined
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 616.31 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1: Kuriachan S, Amberkar MB, Mohan MK, Shahul HA, Kishore MK. Acebrophylline- induced angioedema. Indian J Pharmacol. 2015 Mar-Apr;47(2):219-20. doi: 10.4103/0253-7613.153435. PMID: 25878387; PMCID: PMC4386136. 2: Pozzi E. Acebrophylline: an airway mucoregulator and anti-inflammatory agent. Monaldi Arch Chest Dis. 2007 Jun;67(2):106-15. doi: 10.4081/monaldi.2007.498. PMID: 17695695. 3: Lohar P, Sharma MK, Sahu AK, Rathod R, Sengupta P. Simultaneous bioanalysis and pharmacokinetic interaction study of acebrophylline, levocetirizine and pranlukast in Sprague-Dawley rats. Biomed Chromatogr. 2019 Dec;33(12):e4672. doi: 10.1002/bmc.4672. Epub 2019 Sep 1. PMID: 31386207. 4: Tapadar SR, Das M, Chaudhuri AD, Basak S, Mahapatra AB. The Effect of Acebrophylline vs Sustained Release Theophylline in Patients of COPD- A Comparative Study. J Clin Diagn Res. 2014 Sep;8(9):MC11-4. doi: 10.7860/JCDR/2014/8176.4869. Epub 2014 Sep 20. PMID: 25386474; PMCID: PMC4225926. 5: Sharma A, Adiga S, Chogtu B, Mohapatra AK, Magazine R. Comparing the efficacy and influence on the quality of life of three classes of drugs used in bronchial asthma - a prospective study. J Clin Diagn Res. 2014 Sep;8(9):HC13-5. doi: 10.7860/JCDR/2014/8999.4877. Epub 2014 Sep 20. PMID: 25386456; PMCID: PMC4225908. 6: Agliati G. Effects of a short course of treatment with acebrophylline on the mucus rheological characteristics and respiratory function parameters in patients suffering from chronic obstructive pulmonary disease. J Int Med Res. 1996 May-Jun;24(3):302-10. doi: 10.1177/030006059602400311. PMID: 8725993. 7: Foppoli A, Zema L, Gazzaniga A, Caira MR, Nassimbeni LR, Borkum E, Bettini R, Giordano F. Solid-state chemistry of ambroxol theophylline-7-acetate. J Pharm Sci. 2007 May;96(5):1139-46. doi: 10.1002/jps.20951. PMID: 17455344. 8: Ferretti C, Coppi G, Blengio M, Genazzani E. Inhibitory effect of theophylline, theophylline-7-acetic acid, ambroxol and ambroxol- theophylline-7-acetate on rat lung cAMP phosphodiesterase isoenzymes. Int J Tissue React. 1992;14(1):31-6. PMID: 1328102.