Sulconazole mononitrate

CAT: 0931-T6686-01Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0931-T6686-01Size:25 mg

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CAS Number

61318-91-0

Target

Antifungal, Antibacterial, Antibiotic

Related Pathways

Microbiology/Virology

Purity

0.9992

Bioactivity

Sulconazole mononitrate (Exelderm) is the nitrate salt form of sulconazole, a synthetic imidazole derivative with the antifungal property. Sulconazole mononitrate inhibits fungal cytochrome P-450 sterol C-14 alpha-demethylation, resulting in the accumulation of fungal 14 alpha-methyl sterols and inhibition of the synthesis of ergosterol, an important component of the fungal cell membrane. Inhibition of ergosterol synthesis leads to a disruption of cell membrane permeability, and ultimately inhibition of cell wall synthesis. In addition, Sulconazole mononitrate seems to interfere with the autolytic degradation of fungal DNA and RNA.

Smiles

c1cc(ccc1CSC(Cn1ccnc1)c1c(cc(cc1)Cl)Cl)Cl.[N+](=O)(O)[O-]

Molecular Formula

C18H15Cl3N2S·HNO3

Molecular Weight

460.76

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Sulconazole Nitrate

Sulconazole nitrate is an organic nitrate salt, an imidazole antifungal drug and a conazole antifungal drug.

CAS Number	61318-91-0
PubChem CID	65495
IUPAC Name	1-[2-[(4-chlorophenyl)methylsulfanyl]-2-(2,4-dichlorophenyl)ethyl]imidazole;nitric acid
Molecular Formula	C18H16Cl3N3O3S
Molecular Weight	460.8
Topological Polar Surface Area	109
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Heavy Atom Count	28
Formal Charge	0
Complexity	404

SMILES

C1=CC(=CC=C1CSC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)Cl.[N+](=O)(O)[O-]

InChI

InChI=1S/C18H15Cl3N2S.HNO3/c19-14-3-1-13(2-4-14)11-24-18(10-23-8-7-22-12-23)16-6-5-15(20)9-17(16)21;2-1(3)4/h1-9,12,18H,10-11H2;(H,2,3,4)

InChIKey

CRKGMGQUHDNAPB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 61318-91-0

CID: 65495

Formula: C18H16Cl3N3O3S

MW: 460.8

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	460.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	458.997796
Monoisotopic Mass	458.997796
Topological Polar Surface Area	109 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	404
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

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HY-B1460-01	Sulconazole (mononitrate)
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HY-B1460A	Sulconazole (nitrate)

Sulconazole mononitrate

Chemical Information

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