Products 1488301-79-6

CAS 1488301-79-6 appears in our catalog under these names: Posaconazole Succinyl Ester, Posaconazole Impurity 85, Posaconazole Succinyl Ester, >95% (HPLC), Posaconazole Succinyl Ester, 95%, 95%. Offered by: Chemat Brand, Hubei YoungXin, TRC, Chemat. Available pack sizes: on request, 10mg, 25mg, 50mg, 100mg, 200mg.

Structural formula: {0} (CAS {1})

4-[(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]oxy-4-oxobutanoic acid (CAS 1488301-79-6) is a chemical compound with the molecular formula C41H46F2N8O7 and a molecular weight of 800.8 g/mol. IUPAC name: 4-[(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]oxy-4-oxobutanoic acid. InChIKey: PNRABLJKLZSNNS-VBDJOCTDSA-N.

Identity
Molecular formulaC41H46F2N8O7
Molecular weight800.8 g/mol
IUPAC name4-[(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]oxy-4-oxobutanoic acid
InChIKeyPNRABLJKLZSNNS-VBDJOCTDSA-N
SMILESCC[C@@H]([C@H](C)OC(=O)CCC(=O)O)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)