![N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide structure](/static/products/5903/59032-30-3.webp)
N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide
TL;DR: N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide (CAS 59032-30-3) is a chemical compound with molecular formula C8H3F3N6O and molecular weight 256.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide
Also Known As: N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide, N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoro
| Molecular Formula | C8H3F3N6O |
|---|---|
| Molecular Weight | 256.03 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 1 |
| Exact Mass | 256.03204 |
| Heavy Atoms | 18 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 59032-30-3 |
|---|---|
| SMILES | C1=NC2=NNC(=C2C(=N1)NC(=O)C(F)(F)F)C#N |
| InChIKey | VCRORBVFGWJUHN-UHFFFAOYSA-N |
Product Overview
N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide (CAS 59032-30-3), with molecular formula C8H3F3N6O and molecular weight 256.03 g/mol. IUPAC: N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide.
Chemical Property Profile of N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide
Property Insights of N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide. Following Lipinski's Rule of Five, N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide?
The CAS number of N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide is 59032-30-3.
What is the molecular formula of N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide?
The molecular formula of N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide is C8H3F3N6O.
What is the molecular weight of N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide?
The molecular weight of N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide is 256.03 g/mol.
Where can I buy N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide?
You can request a quote for N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-cyano-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-2,2,2-trifluoroacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.