| Identification | Back Directory | [Name]
2,3-Dehydro Ketoconazole | [CAS]
254912-63-5 | [Synonyms]
Ketoconazole IMpurity A
2,3-Dehydro Ketoconazole
Ketoconazole EP Impurity A
Ketoconazole Impurity 1（Ketoconazole EP Impurity A）
1-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]-2,3-dihydropyrazin-1-yl]ethanone
1-(4-(4-(((2S,4R)-2-((1H-imidazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methoxy)phenyl)-3,4-dihydropyrazin-1(2H)-yl)ethan-1-one
Ethanone, 1-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]-3,4-dihydro-1(2H)-pyrazinyl]-, rel- | [Molecular Formula]
C26H26Cl2N4O4 | [MDL Number]
MFCD30543635 | [MOL File]
254912-63-5.mol | [Molecular Weight]
529.41 |
| Chemical Properties | Back Directory | [Boiling point ]
736.8±60.0 °C(Predicted) | [density ]
1.37±0.1 g/cm3(Predicted) | [pka]
6.88±0.12(Predicted) | [InChIKey]
GHVFISLXKPKRQU-GRHWAJSLNA-N | [SMILES]
C(=O)(N1C=CN(C2=CC=C(OC[C@H]3CO[C@@](C4=CC=C(Cl)C=C4Cl)(CN4C=NC=C4)O3)C=C2)CC1)C |&1:12,15,r| |
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