| Identification | Back Directory | [Name]
Itraconazole Desethylene-seco-piperazine Di-N-formyl Impurity | [CAS]
1199350-02-1 | [Synonyms]
ItracozoleDesethylene-seco-piperazineDi-N-formylImpurity
Itraconazole Desethylene-seco-piperazine Di-N-formyl Impurity
Formamide, N-[2-[[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]formylamino]ethyl]-N-[4-[1,5-dihydro-1-(1-methylpropyl)-5-oxo-4H-1,2,4-triazol-4-yl]phenyl]-, rel- | [Molecular Formula]
C35H36Cl2N8O6 | [MOL File]
1199350-02-1.mol | [Molecular Weight]
735.62 |
| Chemical Properties | Back Directory | [Melting point ]
>67°C (dec.) | [Boiling point ]
908.1±75.0 °C(Predicted) | [density ]
1.40±0.1 g/cm3(Predicted) | [storage temp. ]
-20°C Freezer, Under inert atmosphere | [solubility ]
Chloroform (Slightly) | [form ]
Solid | [pka]
3.14±0.20(Predicted) | [color ]
Light Yellow to Orange | [InChIKey]
GXMOFIXLLZJCFA-SKTMEOIKNA-N | [SMILES]
C(N1N=CN=C1)[C@]1(C2C=CC(Cl)=CC=2Cl)OC[C@H](COC2C=CC(N(C=O)CCN(C3C=CC(N4C=NN(C(C)CC)C4=O)=CC=3)C=O)=CC=2)O1 |&1:6,17,r| |
| Hazard Information | Back Directory | [Uses]
Itraconazole Desethylene-seco-piperazine Di-N-formyl Impurity is a by-product in the synthesis of Itraconazole Desethylene-seco-piperazine Mono-N-formyl Impurity (I937520), which is an impurity of Itraconazole (I937500). Itraconazole is an orally active antimycotic structurally related to Ketoconazole. Antifungal. It is a COVID19-related research product. |
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