![tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate structure](/static/products/155/155601-71-1.webp)
tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate
TL;DR: tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate (CAS 155601-71-1) is a chemical compound with molecular formula C11H12FN3O2 and molecular weight 237.09135 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl 6-fluoro-2H-pyrazolo[3,4-b]pyridine-3-carboxylate
Also Known As: tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate, tert-butyl 6-fluoro-2H-pyrazolo[3,4-b]pyridine-3-carboxylate, 7809AA, 3-Boc-6-fluoro-1H-pyrazolo[3,4-b]pyridine, 3-(tert-Butoxycarbonyl)-6-fluoro-1H-pyrazolo[3,4-b]pyridine
Technical Specifications
| Molecular Formula | C11H12FN3O2 |
| Molecular Weight | 237.09135 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 67.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 237.09135 Da |
| Heavy Atoms | 17 |
| Complexity | 306.0 |
| SMILES | CC(C)(C)OC(=O)C1=C2C=CC(=NC2=NN1)F |
| InChIKey | INGAFDNQIOIZHC-UHFFFAOYSA-N |
Chemical Property Profile of tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate
Property Insights of tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate. Following Lipinski's Rule of Five, tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate?
The CAS number of tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate is 155601-71-1.
What is the molecular formula of tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate?
The molecular formula of tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate is C11H12FN3O2.
What is the molecular weight of tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate?
The molecular weight of tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate is 237.09135 g/mol.
Where can I buy tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate?
You can request a quote for tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate?
Yes, CoreyChem provides custom synthesis services for tert-butyl 6-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.