Itraconazole Desethylene-seco-piperazine Mono-N-formyl Impurity
Product Code
TRC-I937520-10MG
CAS Number
Product Format
Neat
Molecular Formula
C34 H36 Cl2 N8 O5
Molecular Weight
707.61
API Family
ItraconazoleProduct Categories
TRC, Impurity Reference Materials , Antimycotics, Forensic and Toxicology Reference Materials, API Reference Standards & Research Materials, Other antifungals, Antifungals, Pharmaceutical Toxicology Reference Materials
Product Type
APIDrug Type
Antifungals
Documentation
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Product Information
Chemical Data
Analyte Name
Itraconazole Desethylene-seco-Piperazine mono-N-Formyl
CAS Number
1199350-00-9
Molecular Formula
C34 H36 Cl2 N8 O5
Molecular Weight
707.61
Accurate Mass
706.2186
SMILES
CCC(C)N1N=CN(C1=O)c2ccc(NCCN(C=O)c3ccc(OC[C@H]4CO[C@@](Cn5cncn5)(O4)c6ccc(Cl)cc6Cl)cc3)cc2
InChI
InChI=1S/C34H36Cl2N8O5/c1-3-24(2)44-33(46)43(22-40-44)28-7-5-26(6-8-28)38-14-15-41(23-45)27-9-11-29(12-10-27)47-17-30-18-48-34(49-30,19-42-21-37-20-39-42)31-13-4-25(35)16-32(31)36/h4-13,16,20-24,30,38H,3,14-15,17-19H2,1-2H3/t24?,30-,34-/m0/s1
IUPAC
N-[2-[4-(1-butan-2-yl-5-oxo-1,2,4-triazol-4-yl)anilino]ethyl]-N-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]formamide
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
API
Product Format
Neat
API Family
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