![(4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile structure](/static/products/3834/38340-27-1.webp)
(4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile
TL;DR: (4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile (CAS 38340-27-1) 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.
2-(4-amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile
Also Known As: (4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile, 2-(4-amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile, 4-amino-3-cyanomethylpyrazolo[3,4-d]pyrimidine, 1h-pyrazolo[3,4-d]pyrimidine-3-acetonitrile,4-amino-
| Molecular Formula | C7H6N6 |
|---|---|
| Molecular Weight | 174.07 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.0654 |
| Heavy Atoms | 13 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 38340-27-1 |
|---|---|
| SMILES | C1=NC2=NNC(=C2C(=N1)N)CC#N |
| InChIKey | YIPJCRVQAGLPRW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile (CAS 38340-27-1), with molecular formula C7H6N6 and molecular weight 174.07 g/mol. IUPAC: 2-(4-amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile.
Chemical Property Profile of (4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile
Property Insights of (4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile
The XLogP value of -0.5 indicates that (4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile. Following Lipinski's Rule of Five, (4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile has 2 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 (4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile?
The CAS number of (4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile is 38340-27-1.
What is the molecular formula of (4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile?
The molecular formula of (4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile is C7H6N6.
What is the molecular weight of (4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile?
The molecular weight of (4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile is 174.07 g/mol.
Where can I buy (4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile?
You can request a quote for (4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for (4-Amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.