2052306-13-3
2052306-13-3 structure
- Name: TBK1 PROTAC 1
- Chemical Name: N-[(3-{4-[3-(4-{[5-Bromo-4-({3-[(cyclobutylcarbonyl)(methyl)amino]propyl}amino)-2-pyrimidinyl]amino}phenoxy)propoxy]butoxy}propoxy)acetyl]-3-methylvalyl-(4R)-4-hydroxy-N-[4-(4-methyl-1,3-thiazol-5-yl)benzyl]prolinamide
- CAS Number: 2052306-13-3
- Molecular Formula: C53H74BrN9O9S
- Molecular Weight: 1093.179
- Catalog: Signaling Pathways NF-κB IKK
- Create Date: 2020-01-11 17:37:49
- Modify Date: 2024-01-18 17:00:08
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A novel potent, selective TBK1 PROTAC with DC50 of 12 nM, selectively degrades TBK1 with excellent selectivity against a related kinase IKKε; a chemical tool to assess TBK1 as a target in mutant K-Ras cancer cells.
| Name | N-[(3-{4-[3-(4-{[5-Bromo-4-({3-[(cyclobutylcarbonyl)(methyl)amino]propyl}amino)-2-pyrimidinyl]amino}phenoxy)propoxy]butoxy}propoxy)acetyl]-3-methylvalyl-(4R)-4-hydroxy-N-[4-(4-methyl-1,3-thiazol-5-yl)benzyl]prolinamide |
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| Synonyms |
N-[(3-{4-[3-(4-{[5-Bromo-4-({3-[(cyclobutylcarbonyl)(methyl)amino]propyl}amino)-2-pyrimidinyl]amino}phenoxy)propoxy]butoxy}propoxy)acetyl]-3-methylvalyl-(4R)-4-hydroxy-N-[4-(4-methyl-1,3-thiazol-5-yl)benzyl]prolinamide
Prolinamide, N-[2-[3-[4-[3-[4-[[5-bromo-4-[[3-[(cyclobutylcarbonyl)methylamino]propyl]amino]-2-pyrimidinyl]amino]phenoxy]propoxy]butoxy]propoxy]acetyl]-3-methylvalyl-4-hydroxy-N-[[4-(4-methyl-5-thiazolyl)phenyl]methyl]-, (4R)- |
| Description | A novel potent, selective TBK1 PROTAC with DC50 of 12 nM, selectively degrades TBK1 with excellent selectivity against a related kinase IKKε; a chemical tool to assess TBK1 as a target in mutant K-Ras cancer cells. |
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| References | References 1. Crew AP, et al. J Med Chem. 2017 Jul 10. doi: 10.1021/acs.jmedchem.7b00635. View Related Products by Target PROTAC |
| Density | 1.3±0.1 g/cm3 |
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| Molecular Formula | C53H74BrN9O9S |
| Molecular Weight | 1093.179 |
| Exact Mass | 1091.451294 |
| LogP | 4.09 |
| Index of Refraction | 1.604 |