Products 1217524-77-0
CAS 1217524-77-0 appears in our catalog under these names: Hydroxy Itraconazole-d5, >95% (HPLC), (2R,4S)–Hydroxy Itraconazole–d5, (2R,4S)-Hydroxy Itraconazole-d5, 99.40%. Offered by: TRC, GLPBio, MedChemExpress. Available pack sizes: 10mg, 1mg, 1 mg.
4-[4-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-(2,3,4,4,4-pentadeuterio-3-hydroxybutan-2-yl)-1,2,4-triazol-3-one (CAS 1217524-77-0) is a chemical compound with the molecular formula C35H38Cl2N8O5 and a molecular weight of 726.7 g/mol. IUPAC name: 4-[4-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-(2,3,4,4,4-pentadeuterio-3-hydroxybutan-2-yl)-1,2,4-triazol-3-one. InChIKey: ISJVOEOJQLKSJU-VVLLWNLBSA-N.
| Molecular formula | C35H38Cl2N8O5 |
|---|---|
| Molecular weight | 726.7 g/mol |
| IUPAC name | 4-[4-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-(2,3,4,4,4-pentadeuterio-3-hydroxybutan-2-yl)-1,2,4-triazol-3-one |
| InChIKey | ISJVOEOJQLKSJU-VVLLWNLBSA-N |
| SMILES | [2H]C([2H])([2H])C([2H])(C([2H])(C)N1C(=O)N(C=N1)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OC[C@H]5CO[C@](O5)(CN6C=NC=N6)C7=C(C=C(C=C7)Cl)Cl)O |
Computed by PubChem (NCBI)