CAS 195735-34-3 appears in our catalog under these names: Posaconazole Impurity 225, Posaconazole Impurity 57, Posaconazole Acetate. Offered by: Chemat Brand, TRC. Available pack sizes: on request, 500mg.
[(2S,3S)-3-[4-[4-[4-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-5-oxo-1,2,4-triazol-1-yl]pentan-2-yl] acetate (CAS 195735-34-3) is a chemical compound with the molecular formula C39H44F2N8O5 and a molecular weight of 742.8 g/mol. IUPAC name: [(2S,3S)-3-[4-[4-[4-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-5-oxo-1,2,4-triazol-1-yl]pentan-2-yl] acetate. InChIKey: IYVYJWKEFBIQHM-XVXNCFNRSA-N.
| Molecular formula | C39H44F2N8O5 |
|---|---|
| Molecular weight | 742.8 g/mol |
| IUPAC name | [(2S,3S)-3-[4-[4-[4-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-5-oxo-1,2,4-triazol-1-yl]pentan-2-yl] acetate |
| InChIKey | IYVYJWKEFBIQHM-XVXNCFNRSA-N |
| SMILES | CC[C@@H]([C@H](C)OC(=O)C)N1C(=O)N(C=N1)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OC[C@H]5C[C@](OC5)(CN6C=NC=N6)C7=C(C=C(C=C7)F)F |
Computed by PubChem (NCBI)