CAS 3105288-31-8 is the registry number for PROTAC STAT6 degrader-2. Offered by: MedChemExpress. Available pack sizes: Get quote.
[[2-[[(5S,8S,10aR)-8-[(3S,4R)-3-cyano-4-phenylpyrrolidine-1-carbonyl]-3-[2-[1-[1-(2,6-dioxopiperidin-3-yl)-3-methyl-2-oxobenzimidazol-4-yl]piperidin-4-yl]acetyl]-6-oxo-1,2,4,5,8,9,10,10a-octahydropyrrolo[1,2-a][1,5]diazocin-5-yl]carbamoyl]-1-benzothiophen-5-yl]-difluoromethyl]phosphonic acid (CAS 3105288-31-8) is a chemical compound with the molecular formula C51H54F2N9O10PS and a molecular weight of 1054.1 g/mol. IUPAC name: [[2-[[(5S,8S,10aR)-8-[(3S,4R)-3-cyano-4-phenylpyrrolidine-1-carbonyl]-3-[2-[1-[1-(2,6-dioxopiperidin-3-yl)-3-methyl-2-oxobenzimidazol-4-yl]piperidin-4-yl]acetyl]-6-oxo-1,2,4,5,8,9,10,10a-octahydropyrrolo[1,2-a][1,5]diazocin-5-yl]carbamoyl]-1-benzothiophen-5-yl]-difluoromethyl]phosphonic acid. InChIKey: QPDSULYSBGIPNF-DYAQCJGLSA-N.
| Molecular formula | C51H54F2N9O10PS |
|---|---|
| Molecular weight | 1054.1 g/mol |
| IUPAC name | [[2-[[(5S,8S,10aR)-8-[(3S,4R)-3-cyano-4-phenylpyrrolidine-1-carbonyl]-3-[2-[1-[1-(2,6-dioxopiperidin-3-yl)-3-methyl-2-oxobenzimidazol-4-yl]piperidin-4-yl]acetyl]-6-oxo-1,2,4,5,8,9,10,10a-octahydropyrrolo[1,2-a][1,5]diazocin-5-yl]carbamoyl]-1-benzothiophen-5-yl]-difluoromethyl]phosphonic acid |
| InChIKey | QPDSULYSBGIPNF-DYAQCJGLSA-N |
| SMILES | CN1C2=C(C=CC=C2N3CCC(CC3)CC(=O)N4CC[C@H]5CC[C@H](N5C(=O)[C@H](C4)NC(=O)C6=CC7=C(S6)C=CC(=C7)C(F)(F)P(=O)(O)O)C(=O)N8C[C@H]([C@@H](C8)C9=CC=CC=C9)C#N)N(C1=O)C1CCC(=O)NC1=O |
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