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Fosfluconazole

CAT: 0804-HY-100666-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-100666-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Fosfluconazole is a proagent of Fluconazole that is widely used as an antifungal agent.
CAS Number
194798-83-9
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
Fungal
Type
Reference compound
Related Pathways
Anti-infection
Applications
COVID-19-immunoregulation
Field of Research
Infection
Assay Protocol
https://www.medchemexpress.com/Fosfluconazole.html
Purity
99.16
Solubility
DMSO : 6.2 mg/mL (ultrasonic; warming)
Smiles
FC1=CC=C(C(CN2N=CN=C2)(OP(O)(O)=O)CN3N=CN=C3)C(F)=C1
Molecular Formula
C13H13F2N6O4P
Molecular Weight
386.25
Precautions
H302, H315, H319, H335
References & Citations
[1]Hagiya H, et al. Successful treatment of recurrent candidemia due to candidal thrombophlebitis associated with a central venous catheter using a combination of Fosfluconazole and micafungin. Intern Med. 2013;52 (18) :2139-43.|[2]Yuan H, et al. Evaluation of in vitro models for screening alkaline phosphatase-mediated bioconversion of phosphate ester prodrugs. Drug Metab Dispos. 2009 Jul;37 (7) :1443-7.|[3]Aoyama T, et al. Pharmacokinetics of fluconazole and Fosfluconazole after intraperitoneal administration to peritoneal dialysis rats. Drug Metab Pharmacokinet. 2005 Dec;20 (6) :485-90.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
Launched

Chemical Information

Fosfluconazole

Fosfluconazole is a member of triazoles, a conazole antifungal drug and a triazole antifungal drug. It has a role as a prodrug. It is functionally related to a fluconazole.

CAS Number194798-83-9
PubChem CID214356
IUPAC Name[2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-yl] dihydrogen phosphate
Molecular FormulaC13H13F2N6O4P
Molecular Weight386.25
XLogP-0.6
Topological Polar Surface Area128
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count7
Heavy Atom Count26
Formal Charge0
Complexity511
SMILES
C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)OP(=O)(O)O
InChI
InChI=1S/C13H13F2N6O4P/c14-10-1-2-11(12(15)3-10)13(25-26(22,23)24,4-20-8-16-6-18-20)5-21-9-17-7-19-21/h1-3,6-9H,4-5H2,(H2,22,23,24)
InChIKey
GHJWNRRCRIGGIO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fosfluconazole
CAS: 194798-83-9
CID: 214356
Formula: C13H13F2N6O4P
MW: 386.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight386.25
XLogP3-0.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count7
Exact Mass386.07039624
Monoisotopic Mass386.07039624
Topological Polar Surface Area128 Ų
Heavy Atom Count26
Formal Charge0
Complexity511
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
AR-F01597-01Fosfluconazole
A13990-5Fosfluconazole 5mg
A13990-200Fosfluconazole 200mg
A13990-100Fosfluconazole 100mg
A13990-50Fosfluconazole 50mg
A13990-25Fosfluconazole 25mg
A13990-10Fosfluconazole 10mg
A13990-10mM-DFosfluconazole 10mM * 1mL in DMSO
AR-F01603-01Fosfluconazole Phosphate Impurity 3
AR-F01600-01Fosfluconazole Phosphate Impurity 2

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