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Ciclopirox

CAT: 0572-TRC-C432800-50MGSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-C432800-50MGSize:50 mg
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CAS Number
29342-05-0
Synonyms
Ciclopirox; 6-Cyclohexyl-1-hydroxy-4-methylpyridin-2(1H)-one
Hazard Statement
Causes skin irritation
Purity
>95% (HPLC)
Smiles
CC1=CC(=O)N(O)C(=C1)C2CCCCC2
Molecular Formula
C12 H17 N O2
Molecular Weight
207.27
InChI
InChI=1S/C12H17NO2/c1-9-7-11(13(15)12(14)8-9)10-5-3-2-4-6-10/h7-8,10,15H,2-6H2,1H3
Additionnal Information
IUPAC name: 6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Ciclopirox

Ciclopirox is a cyclic hydroxamic acid that is 1-hydroxypyridin-2(1H)-one in which the hydrogens at positions 4 and 6 are substituted by methyl and cyclohexyl groups, respectively. A broad spectrum antigfungal agent, it also exhibits antibacterial activity against many Gram-positive and Gram-negative bacteria, and has anti-inflammatory properties. It is used a a topical treatment of fungal skin and nail infections. It has a role as an antibacterial agent and an antiseborrheic. It is a cyclic hydroxamic acid, a pyridone and a hydroxypyridone antifungal drug.

CAS Number29342-05-0
PubChem CID2749
IUPAC Name6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one
Molecular FormulaC12H17NO2
Molecular Weight207.27
XLogP2
Topological Polar Surface Area40.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count15
Formal Charge0
Complexity325
SMILES
CC1=CC(=O)N(C(=C1)C2CCCCC2)O
InChI
InChI=1S/C12H17NO2/c1-9-7-11(13(15)12(14)8-9)10-5-3-2-4-6-10/h7-8,10,15H,2-6H2,1H3
InChIKey
SCKYRAXSEDYPSA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ciclopirox
CAS: 29342-05-0
CID: 2749
Formula: C12H17NO2
MW: 207.27
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight207.27
XLogP32
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass207.125928785
Monoisotopic Mass207.125928785
Topological Polar Surface Area40.5 Ų
Heavy Atom Count15
Formal Charge0
Complexity325
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

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