| Identification | Back Directory | [Name]
Posaconazole Impurity 18 | [CAS]
213381-06-7 | [Synonyms]
Posacozole Impurity 18
Posaconazole Impurity 18
Posaconazole Impurity(S,R,S,R)
4-(4-(4-(4-(((3S,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-
D-erythro-Pentitol, 1,4-anhydro-2,3,5-trideoxy-4-C-(2,4-difluorophenyl)-2-[[4-[4-[4-[1-[(1S,2R)-1-ethyl-2-hydroxypropyl]-1,5-dihydro-5-oxo-4H-1,2,4-triazol-4-yl]phenyl]-1-piperazinyl]phenoxy]methyl]-5-(1H-1,2,4-triazol-1-yl)- | [Molecular Formula]
C37H42F2N8O4 | [MOL File]
213381-06-7.mol | [Molecular Weight]
700.79 |
| Chemical Properties | Back Directory | [Boiling point ]
850.7±75.0 °C(Predicted) | [density ]
1.36±0.1 g/cm3(Predicted) | [pka]
14.72±0.20(Predicted) | [InChIKey]
RAGOYPUPXAKGKH-KSWQATAHNA-N | [SMILES]
C(N1N=CN=C1)[C@@]1(C2C=CC(F)=CC=2F)OC[C@H](COC2C=CC(N3CCN(C4C=CC(N5C=NN([C@@H](CC)[C@H](O)C)C5=O)=CC=4)CC3)=CC=2)C1 |&1:6,17,36,39,r| |
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