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Fenticonazole Nitrate

CAT: 0572-TRC-F279250-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-F279250-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
73151-29-8
Synonyms
Fenticonazole nitrate; 1-[(2RS)-2-(2,4-Dichlorophenyl)-2-[[4-(phenylsulfanyl)benzyl]oxy]ethyl]-1H-imidazole nitrate; 1H-Imidazole, 1-[2-(2,4-dichlorophenyl)-2-[[4-(phenylthio)phenyl]methoxy]ethyl]-, nitrate (1:1); 1H-Imidazole, 1-[2-(2,4-dichlorophenyl)-2; 1H-Imidazole, 1-[2-(2,4-dichlorophenyl)-2-[[4-(phenylthio)phenyl]methoxy]ethyl]-, mononitrate (9CI); Falvin; Feniconazole nitrate; Fentiderm; REC 15-1476
Hazard Statement
Not a hazardous substance according to GHS.
Purity
>95% (HPLC)
Smiles
O[N+](=O)[O-].Clc1ccc(C(Cn2ccnc2)OCc3ccc(Sc4ccccc4)cc3)c(Cl)c1
Molecular Formula
C24 H20 Cl2 N2 O S . H N O3
Molecular Weight
518.41
InChI
InChI=1S/C24H20Cl2N2OS.HNO3/c25-19-8-11-22(23(26)14-19)24(15-28-13-12-27-17-28)29-16-18-6-9-21(10-7-18)30-20-4-2-1-3-5-20;2-1(3)4/h1-14,17,24H,15-16H2;(H,2,3,4)
Additionnal Information
IUPAC name: 1-[2-(2,4-dichlorophenyl)-2-[(4-phenylsulfanylphenyl)methoxy]ethyl]imidazole;nitric acid
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Fenticonazole Nitrate

Fenticonazole nitrate is a racemate comprising equimolar amounts of (R)- and (S)-fenticonazole nitrate. Used for the treatment of vaginal candidiasis. It has a role as an antibacterial drug. It is a racemate, an imidazole antifungal drug and a conazole antifungal drug. It contains a (S)-fenticonazole nitrate and a (R)-fenticonazole nitrate.

CAS Number73151-29-8
PubChem CID51754
IUPAC Name1-[2-(2,4-dichlorophenyl)-2-[(4-phenylsulfanylphenyl)methoxy]ethyl]imidazole;nitric acid
Molecular FormulaC24H21Cl2N3O4S
Molecular Weight518.4
Topological Polar Surface Area118
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count34
Formal Charge0
Complexity524
SMILES
C1=CC=C(C=C1)SC2=CC=C(C=C2)COC(CN3C=CN=C3)C4=C(C=C(C=C4)Cl)Cl.[N+](=O)(O)[O-]
InChI
InChI=1S/C24H20Cl2N2OS.HNO3/c25-19-8-11-22(23(26)14-19)24(15-28-13-12-27-17-28)29-16-18-6-9-21(10-7-18)30-20-4-2-1-3-5-20;2-1(3)4/h1-14,17,24H,15-16H2;(H,2,3,4)
InChIKey
FJNRUWDGCVDXLU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fenticonazole Nitrate
CAS: 73151-29-8
CID: 51754
Formula: C24H21Cl2N3O4S
MW: 518.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight518.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass517.0629827
Monoisotopic Mass517.0629827
Topological Polar Surface Area118 Ų
Heavy Atom Count34
Formal Charge0
Complexity524
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

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