![4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine structure](/static/products/999/99971-84-3.png)
4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
TL;DR: 4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine (CAS 99971-84-3) is a chemical compound with molecular formula C11H6Cl2N4 and molecular weight 264.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dichloro-1-phenylpyrazolo[5,4-d]pyrimidine
Also Known As: 4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine, 4,6-dichloro-1-phenylpyrazolo[3,4-d]pyrimidine, 1H-Pyrazolo[3,4-d]pyrimidine, 4,6-dichloro-1-phenyl-, 1-phenyl-4,6-dichloropyrazolo[3,4-d]pyrimidine, 4,6-dichloro-1-phenylpyrazolo[5,4-d]pyrimidine
| Molecular Formula | C11H6Cl2N4 |
|---|---|
| Molecular Weight | 264.00 g/mol |
| LogP | 3.1223 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 263.99695 |
| Heavy Atoms | 17 |
| Complexity | 678.5042 |
Chemical Identifiers
| CAS Number | 99971-84-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC(=N3)Cl)Cl |
Product Overview
4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine (CAS 99971-84-3), with molecular formula C11H6Cl2N4 and molecular weight 264.00 g/mol. IUPAC: 4,6-dichloro-1-phenylpyrazolo[5,4-d]pyrimidine.
Chemical Property Profile of 4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Property Insights of 4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
The XLogP value of 3.1223 indicates that 4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.6 Ų, 4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine has 0 hydrogen bond donor(s) and 3 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 4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine?
The CAS number of 4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine is 99971-84-3.
What is the molecular formula of 4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine?
The molecular formula of 4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine is C11H6Cl2N4.
What is the molecular weight of 4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine?
The molecular weight of 4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine is 264.00 g/mol.
Where can I buy 4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine?
You can request a quote for 4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4,6-dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.