![Pyrazolo[3,4-d]pyrimidine 4 structure](/static/products/330/330786-32-8.png)
Pyrazolo[3,4-d]pyrimidine 4
TL;DR: Pyrazolo[3,4-d]pyrimidine 4 (CAS 330786-32-8) is a chemical compound with molecular formula C29H33N7O and molecular weight 495.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[4-amino-1-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-phenylmethanone
Also Known As: Pyrazolo[3,4-d]pyrimidine 4, J1.750.725G, [4-[4-amino-1-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-phenylmethanone, [4-[4-Amino-1-[trans-4-(4-methyl-1-piperazinyl)cyclohexyl]-1H-pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]phenylmethanone, 1-[4beta-(4-Methylpiperazino)cyclohexane-1alpha-yl]-3-(4-benzoylphenyl)-4-amino-1H-pyrazolo[3,4-d]pyrimidine
| Molecular Formula | C29H33N7O |
|---|---|
| Molecular Weight | 495.27 g/mol |
| LogP | 4.0376 |
| Topological Polar Surface Area | 93.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 495.27466 |
| Heavy Atoms | 37 |
| Complexity | 1383.3099 |
Chemical Identifiers
| CAS Number | 330786-32-8 |
|---|---|
| SMILES | CN1CCN(CC1)C2CCC(CC2)N3C4=NC=NC(=C4C(=N3)C5=CC=C(C=C5)C(=O)C6=CC=CC=C6)N |
Product Overview
Pyrazolo[3,4-d]pyrimidine 4 (CAS 330786-32-8), with molecular formula C29H33N7O and molecular weight 495.27 g/mol. IUPAC: [4-[4-amino-1-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-phenylmethanone.
Chemical Property Profile of Pyrazolo[3,4-d]pyrimidine 4
Property Insights of Pyrazolo[3,4-d]pyrimidine 4
The XLogP value of 4.0376 indicates that Pyrazolo[3,4-d]pyrimidine 4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.17 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrazolo[3,4-d]pyrimidine 4. Following Lipinski's Rule of Five, Pyrazolo[3,4-d]pyrimidine 4 has 1 hydrogen bond donor(s) and 7 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 Pyrazolo[3,4-d]pyrimidine 4?
The CAS number of Pyrazolo[3,4-d]pyrimidine 4 is 330786-32-8.
What is the molecular formula of Pyrazolo[3,4-d]pyrimidine 4?
The molecular formula of Pyrazolo[3,4-d]pyrimidine 4 is C29H33N7O.
What is the molecular weight of Pyrazolo[3,4-d]pyrimidine 4?
The molecular weight of Pyrazolo[3,4-d]pyrimidine 4 is 495.27 g/mol.
Where can I buy Pyrazolo[3,4-d]pyrimidine 4?
You can request a quote for Pyrazolo[3,4-d]pyrimidine 4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrazolo[3,4-d]pyrimidine 4?
Yes, KEHONG BIO provides custom synthesis services for Pyrazolo[3,4-d]pyrimidine 4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.