![4-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine structure](/static/products/6506/650628-11-8.webp)
4-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine
TL;DR: 4-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine (CAS 650628-11-8) is a chemical compound with molecular formula C12H9ClN4 and molecular weight 244.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-1-(3-methylphenyl)pyrazolo[5,4-d]pyrimidine
Also Known As: 4-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine, 4-chloro-1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidine, 4-CHLORO-1-(M-TOLYL)-1H-PYRAZOLO[3,4-D]PYRIMIDINE, 4-Chloro-1-m-tolyl-1H-pyrazolo[3,4-d]pyrimidine, AB00674257-01
| Molecular Formula | C12H9ClN4 |
|---|---|
| Molecular Weight | 244.05 g/mol |
| LogP | 2.77732 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.05157 |
| Heavy Atoms | 17 |
| Complexity | 689.7884 |
Chemical Identifiers
| CAS Number | 650628-11-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C3=C(C=N2)C(=NC=N3)Cl |
Product Overview
4-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine (CAS 650628-11-8), with molecular formula C12H9ClN4 and molecular weight 244.05 g/mol. IUPAC: 4-chloro-1-(3-methylphenyl)pyrazolo[5,4-d]pyrimidine.
Chemical Property Profile of 4-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine
Property Insights of 4-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine
The XLogP value of 2.77732 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine. With a topological polar surface area (TPSA) of 43.6 Ų, 4-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-1-(3-methylphenyl)-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-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine?
The CAS number of 4-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine is 650628-11-8.
What is the molecular formula of 4-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine?
The molecular formula of 4-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine is C12H9ClN4.
What is the molecular weight of 4-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine?
The molecular weight of 4-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine is 244.05 g/mol.
Where can I buy 4-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine?
You can request a quote for 4-chloro-1-(3-methylphenyl)-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-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.