- Identification

- Properties

- Safety Data

- Specifications & Other Information

- Links

- Quick Inquiry

Identification

CAS Number

171228-49-2

Name

Posaconazole

Synonyms

171228-49-2 2,5-Anhydro-1,3,4-trideoxy-2-(2,4-difluorophenyl)-4-({4--5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl}phenyl)piperazin-1-yl]phenoxy}methyl)-1-(1H-1,2,4-triazol-1-yl)-D-threo-pentitol2,5-Anhydro-1,3,4-trideoxy-2-(2,4-difluorophenyl)-4-({4--5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl}phenyl)-1-piperazinyl]phenoxy}methyl)-1-(1H-1,2,4-triazol-1-yl)- D-threo-pentitol 2,5-Anhydro-1,3,4-trideoxy-2-(2,4-difluorophenyl)-4-({4--5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl}phenyl)piperazin-1-yl]phenoxy}methyl)-1-(1H-1,2,4-triazol-1-yl)-D-threo-pentitol2,5-Anhydro-1,3,4-tridésoxy-2-(2,4-difluorophényl)-4-({4--5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl}phényl)-1-pipérazinyl]phénoxy}méthyl)-1-(1H-1,2,4-triazol-1-yl) -D-thréo-pentitol  2,5-Anhydro-1,3,4-tridesoxy-2-(2,4-difluorphenyl)-4-({4--5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl}phenyl)-1-piperazinyl]phenoxy}methyl)-1-(1H-1,2,4-triazol-1-yl)- D-threo-pentitol  4-methoxy]phenyl]piperazin-1-yl]phenyl]-2--1,2,4-triazol-3-one4-{4-methoxy}phenyl)piperazin-1-yl]phenyl}-2--2,4-dihydro-3H-1,2,4-triazol-3-one4-{4-méthoxy}phényl)pipérazin-1-yl]phényl}-2--2,4-dihydro-3H-1,2,4-triazol-3-one6TK1G07BHZD-threo-Pentitol, 2,5-anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4--1,5-dihydro-5-oxo-4H-1,2,4-triazol-4-yl]phenyl]-1-piperazinyl]phenoxy]methyl]-1-( 1H-1,2,4-triazol-1-yl)- D-threo-pentitol, 2,5-anhydro-1,

SMILES

CC((C)O)n1c(=O)n(cn1)c2ccc(cc2)N3CCN(CC3)c4ccc(cc4)OC5C(OC5)(Cn6cncn6)c7ccc(cc7F)F

StdInChI

InChI=1S/C37H42F2N8O4/c1-3-35(26(2)48)47-36(49)46(25-42-47)31-7-5-29(6-8-31)43-14-16-44(17-15-43)30-9-11-32(12-10-30)50-20-27-19-37(51-21-27,22-45-24-40-23-41-45)33-13-4-28(38)18-34(33)39/h4-13,18,23-27,35,48H,3,14-17,19-22H2,1-2H3/t26-,27+,35-,37-/m0/s1

StdInChIKey

RAGOYPUPXAKGKH-XAKZXMRKSA-N

Molecular Formula

C37H42F2N8O4

Molecular Weight

700.777

MDL Number

MFCD00941162

Properties

Appearance

white to off-white powder

Melting point

166°C~169°C

Structure

structure of Posaconazole CAS 171228-49-2

Safety Data

Symbol

WGK Germany

3

MSDS Download

Specifications and Other Information of Our

Identification Methods

HNMR, HPLC

Assay

102.0%

Specific Optical Rotation

-25°􀁙-30°

Related substances

Impurity 17 ≤0.15%Any unspecified single impurity ≤0.1%Total impurities ≤0.5%Single impurity (RRT0.45~0.75) ≤0.10%Total impurities (RRT0.45~0.75) ≤0.5%

Residual solvent

Toluene≤ 0.089%Methanol≤ 0.3%Isopropanol ≤ 0.5%Dichloromethane ≤0.06%N,N-Dimethylformamide ≤0.088%

Loss on Drying

≤O.5%

Residue on Ignition

≤0.1%

Methyl tert-butyl ether

Methyl tert-butyl ether ≤0.5%

Palladium

≤ 10ppm

Microbial Limit

Total aerobic microbial count ≤1000cfu/gTotal yeast and molds count ≤100cfu/gEscherichia coli should not be detected

Polymorphism

The XRD pattern of this product should be consistent with that of posaconazole crystal form I

Shelf Life

2 years

Storage

Under room temperature away from light

Known Application

Posaconazole is a second-generation triazole antifungal drug widely used for the prevention and treatment of invasive fungal infections.

General View of Documents

Links

This product is developed by our R&D company Caming Pharmaceutical Limited (http://www.caming.com/).

Quick Inquiry

Fill out our inquiry form and one of our experts will be in touch with you shortly.
https://www.watson-int.com/posaconazole-cas-171228-49-2-5/