Products for Research Use Only
RegisterLogin

Isavuconazonium sulfate

CAT: 1410-M17685-01Size: 1 EachDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1410-M17685-01Size:1 Each
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Isavuconazonium sulfate is hydrolyzed by plasma esterases to yield the active moiety isavuconazole.
CAS Number
946075-13-4
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
814.84
Molecular Formula
C35H36F2N8O9S2
Notes
Research use only, not for human use.
Receptor
Inhibits the synthesis of ergosterol| lanosterol 15 alpha-demethylase inhibitor

Chemical Information

Isavuconazonium Sulfate

Isavuconazonium sulfate is an azaheterocycle sulfate salt that is a prodrug for isavuconazole, an antifungal agent used for the treatment of invasive aspergillosis and invasive mucormycosis. It has a role as a prodrug, an orphan drug, an ergosterol biosynthesis inhibitor and an EC 1.14.13.70 (sterol 14alpha-demethylase) inhibitor. It is an azaheterocycle sulfate salt, a conazole antifungal drug and a triazole antifungal drug. It contains an isavuconazonium.

CAS Number946075-13-4
PubChem CID72196309
IUPAC Name[2-[1-[1-[(2R,3R)-3-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-2-(2,5-difluorophenyl)-2-hydroxybutyl]-1,2,4-triazol-4-ium-4-yl]ethoxycarbonyl-methylamino]-3-pyridinyl]methyl 2-(methylamino)acetate;hydrogen sulfate
Molecular FormulaC35H36F2N8O9S2
Molecular Weight814.8
Topological Polar Surface Area273
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count17
Rotatable Bond Count15
Heavy Atom Count56
Formal Charge0
Complexity1290
SMILES
C[C@@H](C1=NC(=CS1)C2=CC=C(C=C2)C#N)[C@](CN3C=[N+](C=N3)C(C)OC(=O)N(C)C4=C(C=CC=N4)COC(=O)CNC)(C5=C(C=CC(=C5)F)F)O.OS(=O)(=O)[O-]
InChI
InChI=1S/C35H35F2N8O5S.H2O4S/c1-22(33-42-30(18-51-33)25-9-7-24(15-38)8-10-25)35(48,28-14-27(36)11-12-29(28)37)19-45-21-44(20-41-45)23(2)50-34(47)43(4)32-26(6-5-13-40-32)17-49-31(46)16-39-3;1-5(2,3)4/h5-14,18,20-23,39,48H,16-17,19H2,1-4H3;(H2,1,2,3,4)/q+1;/p-1/t22-,23?,35+;/m0./s1
InChIKey
LWXUIUUOMSMZKJ-KLFWAVJMSA-M
Chemical Structure
2D Structure
2D structure of Isavuconazonium Sulfate
CAS: 946075-13-4
CID: 72196309
Formula: C35H36F2N8O9S2
MW: 814.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight814.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count17
Rotatable Bond Count15
Exact Mass814.20147343
Monoisotopic Mass814.20147343
Topological Polar Surface Area273 Ų
Heavy Atom Count56
Formal Charge0
Complexity1290
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

Related Products

CatalogName
M14889-01Sisomicin Sulfate
M13759-01Kanamycin sulfate
M11700-01Capreomycin sulfate
M35235Magnesium sulfate
M27604-01Arcaine sulfate
M18687-01Salbutamol Sulfate
M17859-01Cefquinome sulfate
M34432-01Sulcardine sulfate
M34175-01Bedoradrine sulfate
M34072-01Efegatran sulfate

Alternative Products

CatalogName
HY-100373-01Isavuconazonium (sulfate)
T3934-01Isavuconazonium sulfate
HY-100373RIsavuconazonium (sulfate) (Standard)
TRC-I893431-100MGIsavuconazonium Sulfate d3
TRC-C964260-75MG(2S,3S)-Isavuconazonium Sulfate
TRC-N137473-5MGN-Nitroso Isavuconazonium Sulfate
A24588-50Isavuconazonium sulfate (BAL8557-002) 50mg
A24588-10Isavuconazonium sulfate (BAL8557-002) 10mg
A24588-100Isavuconazonium sulfate (BAL8557-002) 100mg
A24588-5Isavuconazonium sulfate (BAL8557-002) 5mg

Popular Products