(2R,4S)-1-((R)-2-(2-(4-(3-(3-Acrylamido-4-phenoxyphenyl)-4-amino-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)acetamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide

Catalog No. :: ACUHRE289
CAS No. :: 2103331-95-7
Molecular Formula :: C49H55N11O6S
Molecular Weight :: 926.12

IUPAC Name:(2R,4S)-1-((R)-2-(2-(4-(3-(3-acrylamido-4-phenoxyphenyl)-4-amino-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)acetamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide

(2R,4S)-1-((R)-2-(2-(4-(3-(3-Acrylamido-4-phenoxyphenyl)-4-amino-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)acetamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide structure diagram

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Product Information

Product Name	(2R,4S)-1-((R)-2-(2-(4-(3-(3-Acrylamido-4-phenoxyphenyl)-4-amino-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)acetamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide
IUPAC Name	(2R,4S)-1-((R)-2-(2-(4-(3-(3-acrylamido-4-phenoxyphenyl)-4-amino-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)acetamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide
Molecular Formula	C49H55N11O6S
Molecular Weight	926.12
SMILES	O=C([C@@H]1N(C([C@H](NC(CN2CCC(N3N=C(C4=CC=C(OC5=CC=CC=C5)C(NC(C=C)=O)=C4)C6=C(N)N=CN=C63)CC2)=O)C(C)(C)C)=O)C[C@@H](O)C1)NCC7=CC=C(C8=C(C)N=CS8)C=C7
InChI Key	OVCGHYOSRVGRMJ-RQWACUIYSA-N
Synonym	PROTAC Her3 Degrader-8;(2R,4S)-1-((R)-2-(2-(4-(3-(3-Acrylamido-4-phenoxyphenyl)-4-amino-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)acetamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide
CAS No.	2103331-95-7

Safety Data

Pictogram
Signal Word: Warning
Hazard Statement(s): H302-H315-H319
Precautionary Statement(s): P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P501

Synthetic Route by SureRoute

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(2R,4S)-1-((R)-2-(2-(4-(3-(3-Acrylamido-4-phenoxyphenyl)-4-amino-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)acetamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide

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Synthetic Route by SureRoute

1. ACUHRE289 Molecular Building Block Synthetic Route

2. ACUHRE289 Molecular Building Block Synthetic Route

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(2R,4S)-1-((R)-2-(2-(4-(3-(3-Acrylamido-4-phenoxyphenyl)-4-amino-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)acetamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide

Product Information

Safety Data

Synthetic Route by SureRoute

2-(2-(2-(4-(4-Amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)ethoxy)ethoxy)-N-(2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-5-yl)acetamide

PROTAC BTK Degrader-3

5-(3-((4-(2-(4-(4-Amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)-2-oxoethyl)piperazin-1-yl)methyl)azetidin-1-yl)-2-(2,6-dioxopiperidin-3-yl)isoindoline-1,3-dione

(1R)-1-[Bis(2-methoxyphenyl)phosphino]-2-[(4S)-4,5-dihydro-4-(1-methylethyl)-2-oxazolyl]ferrocene

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