Iodiconazole | CAS#887138-63-8 | antifungal

MedKoo Cat#: 326963 | Name: Iodiconazole

Description:

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

Iodiconazole is an azole antifungal potentially for the treatment of fungal infection.

Chemical Structure

Iodiconazole

CAS#887138-63-8

Theoretical Analysis

MedKoo Cat#: 326963

Name: Iodiconazole

CAS#: 887138-63-8

Chemical Formula: C19H19F2IN4O

Exact Mass: 484.0572

Molecular Weight: 484.29

Elemental Analysis: C, 47.12; H, 3.95; F, 7.85; I, 26.20; N, 11.57; O, 3.30

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

Iodiconazole

IUPAC/Chemical Name

2-(2,4-difluorophenyl)-1-((4-iodobenzyl)(methyl)amino)-3-(1H-1,2,4-triazol-1-yl)propan-2-ol

InChi Key

VDBLUAHBFVLQSJ-UHFFFAOYSA-N

InChi Code

InChI=1S/C19H19F2IN4O/c1-25(9-14-2-5-16(22)6-3-14)10-19(27,11-26-13-23-12-24-26)17-7-4-15(20)8-18(17)21/h2-8,12-13,27H,9-11H2,1H3

SMILES Code

OC(CN(CC1=CC=C(I)C=C1)C)(C2=CC=C(F)C=C2F)CN3N=CN=C3

Appearance

Solid powder

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

Soluble in DMSO

Shelf Life

>2 years if stored properly

Drug Formulation

This drug may be formulated in DMSO

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

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 484.29 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.

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: Zhao H, She XD, Yu XX, Fu JF, Chen Y, Tian Y, Zhang ZJ. Quantification of iodiconazole by LC-MS/MS, a new topical transdermal cream, in dermatophytosis patients' plasma. Bioanalysis. 2015;7(7):895-905. doi: 10.4155/bio.15.19. PubMed PMID: 25932523. 2: Jiang Z, Wang Y, Wang W, Wang S, Xu B, Fan G, Dong G, Liu Y, Yao J, Miao Z, Zhang W, Sheng C. Discovery of highly potent triazole antifungal derivatives by heterocycle-benzene bioisosteric replacement. Eur J Med Chem. 2013 Jun;64:16-22. doi: 10.1016/j.ejmech.2013.04.025. Epub 2013 Apr 17. PubMed PMID: 23643831. 3: Sun N, Xie Y, Sheng C, Cao Y, Zhang W, Chen H, Fan G. In vivo pharmacokinetics and in vitro antifungal activity of iodiconazole, a new triazole, determined by microdialysis sampling. Int J Antimicrob Agents. 2013 Mar;41(3):229-35. doi: 10.1016/j.ijantimicag.2012.10.020. Epub 2013 Jan 6. PubMed PMID: 23298433. 4: Xiong HP, Gao SH, Li CT, Wu ZJ. (2RS)-2-(2,4-Difluoro-phen-yl)-1-[(4-iodo-benz-yl)(meth-yl)amino]-3-(1H-1,2,4-tri -azol-1-yl)propan-2-ol. Acta Crystallogr Sect E Struct Rep Online. 2012 Aug 1;68(Pt 8):o2447-8. doi: 10.1107/S160053681203139X. Epub 2012 Jul 14. PubMed PMID: 22904893; PubMed Central PMCID: PMC3414360. 5: Li W, Tan G, Zhao L, Chen X, Zhang X, Zhu Z, Chai Y. Computer-aided molecular modeling study of enantioseparation of iodiconazole and structurally related triadimenol analogues by capillary electrophoresis: chiral recognition mechanism and mathematical model for predicting chiral separation. Anal Chim Acta. 2012 Mar 9;718:138-47. doi: 10.1016/j.aca.2012.01.007. Epub 2012 Jan 12. PubMed PMID: 22305909. 6: Sun N, Wen J, Lu G, Hong Z, Fan G, Wu Y, Sheng C, Zhang W. An ultra-fast LC method for the determination of iodiconazole in microdialysis samples and its application in the calibration of laboratory-made linear probes. J Pharm Biomed Anal. 2010 Jan 5;51(1):248-51. doi: 10.1016/j.jpba.2009.07.016. Epub 2009 Jul 22. PubMed PMID: 19695826. 7: Gao S, Tao X, Sun L, Sheng C, Zhang W, Yun Y, Li J, Miao H, Chen W. An liquid chromatography-tandem mass spectrometry assay for determination of trace amount of new antifungal drug iodiconazole in human plasma. J Chromatogr B Analyt Technol Biomed Life Sci. 2009 Feb 1;877(4):382-6. doi: 10.1016/j.jchromb.2008.12.034. Epub 2008 Dec 24. PubMed PMID: 19124284.