![6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine structure](/static/products/104/10406-15-2.webp)
6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine
TL;DR: 6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine (CAS 10406-15-2) is a chemical compound with molecular formula C12H8ClN5O3 and molecular weight 305.03156 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-chloro-1-methyl-4-(4-nitrophenoxy)pyrazolo[5,4-d]pyrimidine
Also Known As: 6-chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine, 6-chloro-1-methyl-4-(4-nitrophenoxy)pyrazolo[3,4-d]pyrimidine
Technical Specifications
| Molecular Formula | C12H8ClN5O3 |
| Molecular Weight | 305.03156 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 98.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 305.03156 Da |
| Heavy Atoms | 21 |
| Complexity | 388.0 |
| SMILES | CN1C2=C(C=N1)C(=NC(=N2)Cl)OC3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | SLYVJNFHSOITSA-UHFFFAOYSA-N |
Chemical Property Profile of 6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine
Property Insights of 6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine. The TPSA of 98.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine. Following Lipinski's Rule of Five, 6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine?
The CAS number of 6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine is 10406-15-2.
What is the molecular formula of 6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine?
The molecular formula of 6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine is C12H8ClN5O3.
What is the molecular weight of 6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine?
The molecular weight of 6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine is 305.03156 g/mol.
Where can I buy 6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine?
You can request a quote for 6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine?
Yes, CoreyChem provides custom synthesis services for 6-Chloro-1-methyl-4-(4-nitrophenoxy)-1h-pyrazolo[3,4-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.