Account PROTAC EGFR degrader 3
- Catalog No. :
- ACICOS403
- CAS No. :
- 2768472-28-0
- Molecular Formula :
- C60H77N13O5S
- Molecular Weight :
- 1092.43
IUPAC Name:(2S,4R)-1-((S)-2-(8-(4-(4-((9-((S)-1-acryloylpiperidin-3-yl)-8-(phenylamino)-9H-purin-2-yl)amino)phenyl)piperazin-1-yl)octanamido)-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 | PROTAC EGFR degrader 3 |
|---|---|
| IUPAC Name | (2S,4R)-1-((S)-2-(8-(4-(4-((9-((S)-1-acryloylpiperidin-3-yl)-8-(phenylamino)-9H-purin-2-yl)amino)phenyl)piperazin-1-yl)octanamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-((S)-1-(4-(4-methylthiazol-5-yl)phenyl)ethyl)pyrrolidine-2-carboxamide |
| Molecular Formula | C60H77N13O5S |
| Molecular Weight | 1092.43 |
| SMILES | O=C([C@H]1N(C([C@@H](NC(CCCCCCCN2CCN(C3=CC=C(NC4=NC=C5N=C(NC6=CC=CC=C6)N([C@@H]7CN(C(C=C)=O)CCC7)C5=N4)C=C3)CC2)=O)C(C)(C)C)=O)C[C@H](O)C1)N[C@H](C8=CC=C(C9=C(C)N=CS9)C=C8)C |
| InChI Key | RYXQXEGTLNBKEC-DKQRTKIFSA-N |
| Synonym | PROTAC EGFR degrader 3;L-Prolinamide, 3-methyl-N-[1-oxo-8-[4-[4-[[9-[(3S)-1-(1-oxo-2-propen-1-yl)-3-piperidinyl]-8-(phenylamino)-9H-purin-2-yl]amino]phenyl]-1-piperazinyl]octyl]-L-valyl-4-hydroxy-N-[(1S)-1-[4-(4-methyl-5-thiazolyl)phenyl]ethyl]-, (4R)- |
| CAS No. | 2768472-28-0 |
Synthetic Route by SureRoute
2. ACICOS403 Molecular Building Block Synthetic Route
(2S,4R)-1-((S)-2-(7-(4-(4-((9-Cyclopentyl-8-(phenylamino)-9H-purin-2-yl)amino)phenyl)piperazin-1-yl)heptanamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide
(2S,4R)-1-((S)-2-(7-(4-(6-((6-Acetyl-8-cyclopentyl-5-methyl-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-2-yl)amino)pyridin-3-yl)piperazin-1-yl)-7-oxoheptanamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide
(2S,4R)-N-((1S,4S)-6-(4-(4-Bromo-7-cyclopentyl-5-oxo-5,7-dihydrobenzo[4,5]imidazo[1,2-a]quinazolin-9-yl)piperidin-1-yl)-4-methyl-1-(4-(4-methylthiazol-5-yl)phenyl)hexyl)-1-((S)-2-(1-fluorocyclopropane-1-carboxamido)-3,3-dimethylbutanoyl)-4-hydroxypyrrolidine-2-carboxamide