![3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile structure](/static/products/1901/1901-68-4.webp)
3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
TL;DR: 3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile (CAS 1901-68-4) is a chemical compound with molecular formula C7H6N6 and molecular weight 174.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-diamino-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile
Also Known As: 3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile, 3,6-diamino-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile, J2.864.319E, 3,6-Diamino-1H-pyrazolo[3,4-b]piridina-5-carbonitrile
| Molecular Formula | C7H6N6 |
|---|---|
| Molecular Weight | 174.07 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 174.0654 |
| Heavy Atoms | 13 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 1901-68-4 |
|---|---|
| SMILES | C1=C(C(=NC2=NNC(=C21)N)N)C#N |
| InChIKey | QQMCPWOEDXMLTH-UHFFFAOYSA-N |
Product Overview
3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile (CAS 1901-68-4), with molecular formula C7H6N6 and molecular weight 174.07 g/mol. IUPAC: 3,6-diamino-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile.
Chemical Property Profile of 3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
Property Insights of 3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile. Following Lipinski's Rule of Five, 3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile has 3 hydrogen bond donor(s) and 5 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 3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile?
The CAS number of 3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile is 1901-68-4.
What is the molecular formula of 3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile?
The molecular formula of 3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile is C7H6N6.
What is the molecular weight of 3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile?
The molecular weight of 3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile is 174.07 g/mol.
Where can I buy 3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile?
You can request a quote for 3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3,6-diamino-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.