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Posaconazole

Posaconazole

CAS: 171228-49-2

Molecular Formula: C37H42F2N8O4

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Posaconazole - Names and Identifiers

Name Posaconazole
Synonyms Noxafil
NOXAFIL
Sch 56592
Posaconazole
Posaconazole(Form Ⅲ)
Posaconazole for research
HYDROXYPROPYL]-2,4-DIHYDRO-3H-1,2,4-TRIAZOL-3-ONE
4-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-Triazol-1-yl)methyl)-5-(2,4-difluorobenzyl)tetrahydrofuran-3
4-[4-[4-[4-[[(3R,5R)-5-(2,4-Difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-[(2S,3S)-2-hydroxypentan-3-yl]-1,2,4-triazol-3-one
4-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-((2S,3S)-2-hydroxypentan-3-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
2,5-Anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-[[4-[4-[4-[1-[(1S,2S)-1-ethyl-2-hydroxypropyl]-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
(2xi)-1,4-anhydro-2,3,5-trideoxy-4-(2,4-difluorophenyl)-2-({4-[4-(4-{1-[(2S,3S)-2-hydroxypentan-3-yl]-5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl}phenyl)piperazin-1-yl]phenoxy}methyl)-5-(1H-1,2,4-triazol-1-yl)-D-glycero-pentitol
CAS 171228-49-2
EINECS 682-747-8
InChI InChI=1/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
InChIKey RAGOYPUPXAKGKH-XAKZXMRKSA-N

Posaconazole - Physico-chemical Properties

Molecular FormulaC37H42F2N8O4
Molar Mass700.78
Density1.36±0.1 g/cm3(Predicted)
Melting Point170-1720C
Boling Point850.7±75.0 °C(Predicted)
Flash Point9℃
Solubility DMSO 140 mg/mL Water <1 mg/mL Ethanol <1 mg/mL
Vapor Presure8.76E-31mmHg at 25°C
AppearanceWhite solid
Colorwhite to beige
Merck14,7602
pKa14.72±0.20(Predicted)
Storage Condition-20°C
Refractive Index1.657
UseA triazole anti-fungal

Posaconazole - Risk and Safety

Risk CodesR11 - Highly Flammable
R23/24/25 - Toxic by inhalation, in contact with skin and if swallowed.
R39/23/24/25 -
Safety DescriptionS7 - Keep container tightly closed.
S16 - Keep away from sources of ignition.
S36/37 - Wear suitable protective clothing and gloves.
S45 - In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
UN IDsUN1230 - class 3 - PG 2 - Methanol, solution
WGK Germany3
RTECSXZ5481020

Posaconazole - Introduction

The Posaconazole is a sterol C14ɑdemethylase inhibitor with an IC50 of 0.25 nM.
Last Update：2022-10-16 17:14:24
Posaconazole
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CAS: 171228-49-2
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Email: sales@tnjchem.com
　　　　 info@tnjchem.com
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Posaconazole
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