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Posaconazole Basic information
Pharmacological effects Pharmacokinetics Clinical indications and usage
Product Name: Posaconazole
Synonyms: 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;4-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-Triazol-1-yl)methyl)-5-(2,4-difluorobenzyl)tetrahydrofuran-3;Posaconazole(Form Ⅲ);Posaconazole;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;Noxafil;Sch 56592;HYDROXYPROPYL]-2,4-DIHYDRO-3H-1,2,4-TRIAZOL-3-ONE
CAS: 171228-49-2
MF: C37H42F2N8O4
MW: 700.78
EINECS: 682-747-8
Product Categories: API;Noxafil;Chiral Reagents;Intermediates & Fine Chemicals;Pharmaceuticals;Inhibitors;171228-49-2
Mol File: 171228-49-2.mol
Posaconazole Structure
Posaconazole Chemical Properties
Melting point 170-1720C
Boiling point 850.7±75.0 °C(Predicted)
density 1.36±0.1 g/cm3(Predicted)
Fp 9℃
storage temp. -20°C
solubility Chloroform (Slightly), Methanol (Slightly)
pka 14.72±0.20(Predicted)
form powder
color white to beige
optical activity [α]/D -24 to -32°, c = 1.0 in chloroform-d
Merck 14,7602
InChIKey RAGOYPUPXAKGKH-XAKZXMRKSA-N
SMILES [C@]1(OC[C@@H](COC2C=CC(N3CCN(C4=CC=C(N5C=NN([C@@H](CC)[C@@H](O)C)C5=O)C=C4)CC3)=CC=2)C1)(CN1N=CN=C1)C1=CC=C(F)C=C1F |&1:0,3,22,25,r|
CAS DataBase Reference 171228-49-2(CAS DataBase Reference)
China
