Products for Research Use Only
RegisterLogin

Butoconazole nitrate 500mg

CAT: 0628-A11646-500Size: 500 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0628-A11646-500Size:500 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
64872-77-1

Chemical Information

Butoconazole Nitrate

Butoconazole nitrate is an organic nitrate salt obtained by reaction of equimolar amounts of butaconazole and nitric acid. An antifungal agent, it is used in gynaecology for treatment of vulvovaginal infections caused by Candida species, particularly Candida albicans. It is a member of imidazoles, an aryl sulfide, an organic nitrate salt, an imidazole antifungal drug and a conazole antifungal drug. It contains a butoconazole(1+).

CAS Number64872-77-1
PubChem CID47471
IUPAC Name1-[4-(4-chlorophenyl)-2-(2,6-dichlorophenyl)sulfanylbutyl]imidazole;nitric acid
Molecular FormulaC19H18Cl3N3O3S
Molecular Weight474.8
Topological Polar Surface Area109
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count29
Formal Charge0
Complexity408
SMILES
C1=CC(=C(C(=C1)Cl)SC(CCC2=CC=C(C=C2)Cl)CN3C=CN=C3)Cl.[N+](=O)(O)[O-]
InChI
InChI=1S/C19H17Cl3N2S.HNO3/c20-15-7-4-14(5-8-15)6-9-16(12-24-11-10-23-13-24)25-19-17(21)2-1-3-18(19)22;2-1(3)4/h1-5,7-8,10-11,13,16H,6,9,12H2;(H,2,3,4)
InChIKey
ZHPWRQIPPNZNML-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Butoconazole Nitrate
CAS: 64872-77-1
CID: 47471
Formula: C19H18Cl3N3O3S
MW: 474.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight474.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass473.013446
Monoisotopic Mass473.013446
Topological Polar Surface Area109 Ų
Heavy Atom Count29
Formal Charge0
Complexity408
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

Related Products

CatalogName
A17605-500Butoconazole 500mg
A11646-200Butoconazole nitrate 200mg
A11646-100Butoconazole nitrate 100mg
A11646-50Butoconazole nitrate 50mg
A11646-10mM-DButoconazole nitrate 10mM * 1mL in DMSO
A10342-500Econazole nitrate 500mg
A11852-500Fenticonazole nitrate 500mg
A10481-500Isoconazole nitrate 500mg
A17605-100Butoconazole 100mg
A17605-10Butoconazole 10mg

Alternative Products

CatalogName
B1902-5.1Butoconazole nitrate
HY-B0293-01Butoconazole (nitrate)
HY-B0293R-01Butoconazole (nitrate) (Standard)
TRC-B690272-10MGrac Butoconazole-d5 Nitrate

Popular Products