Account A031
- Catalog No. :
- ACLETS532
- CAS No. :
- 2682255-44-1
- Molecular Formula :
- C50H61ClN10O7S
- Molecular Weight :
- 981.62
IUPAC Name:(2S,4R)-1-((S)-2-(2-(2-(4-(5-((1R,3r,5S)-3-(3-chloro-4-cyanophenoxy)-8-azabicyclo[3.2.1]octane-8-carbonyl)pyrimidin-2-yl)piperazin-1-yl)ethoxy)acetamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-((S)-1-(4-(4-methylthiazol-5-yl)phenyl)ethyl)pyrrolidine-2-carboxamide
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Product Information
| Product Name | A031 |
|---|---|
| IUPAC Name | (2S,4R)-1-((S)-2-(2-(2-(4-(5-((1R,3r,5S)-3-(3-chloro-4-cyanophenoxy)-8-azabicyclo[3.2.1]octane-8-carbonyl)pyrimidin-2-yl)piperazin-1-yl)ethoxy)acetamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-((S)-1-(4-(4-methylthiazol-5-yl)phenyl)ethyl)pyrrolidine-2-carboxamide |
| Molecular Formula | C50H61ClN10O7S |
| Molecular Weight | 981.62 |
| SMILES | CC1=C(C2=CC=C([C@H](C)NC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](NC(=O)COCCN3CCN(C4=NC=C(C(=O)N5[C@@H]6CC[C@H]5C[C@@H](OC5=CC=C(C#N)C(Cl)=C5)C6)C=N4)CC3)C(C)(C)C)C=C2)SC=N1 |
| InChI Key | PGVTULUCNZWYPD-YRHZNJHBSA-N |
| Synonym | (2S,4R)-1-[(2S)-2-[[2-[2-[4-[5-[(1S,5R)-3-(3-chloro-4-cyanophenoxy)-8-azabicyclo[3.2.1]octane-8-carbonyl]pyrimidin-2-yl]piperazin-1-yl]ethoxy]acetyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide |
| CAS No. | 2682255-44-1 |
Synthetic Route by SureRoute
2. ACLETS532 Molecular Building Block Synthetic Route
(2S,4R)-N-((S)-3-(4-((4-((trans-3-(3-Chloro-4-cyanophenoxy)-2,2,4,4-tetramethylcyclobutyl)carbamoyl)phenyl)ethynyl)-[1,4'-bipiperidin]-1'-yl)-1-(4-(4-methylthiazol-5-yl)phenyl)-3-oxopropyl)-1-((S)-2-(1-fluorocyclopropanecarboxamido)-3,3-dimethylbutanoyl)-4-hydroxypyrrolidine-2-carboxamide
ZXH-4-137
PROTAC AR-V7 degrader-1