4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine
TL;DR: 4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine (CAS 42951-67-7) is a chemical compound with molecular formula C8H9N5O2 and molecular weight 207.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dimethyl-5-nitro-2H-pyrazolo[3,4-b]pyridin-3-amine
Also Known As: 4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine, 4,6-dimethyl-5-nitro-2H-pyrazolo[3,4-b]pyridin-3-amine
| Molecular Formula | C8H9N5O2 |
|---|---|
| Molecular Weight | 207.08 g/mol |
| LogP | 1.06514 |
| Topological Polar Surface Area | 110.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 207.07562 |
| Heavy Atoms | 15 |
| Complexity | 559.64764 |
Chemical Identifiers
| CAS Number | 42951-67-7 |
|---|---|
| SMILES | CC1=C(C(=NC2=NNC(=C12)N)C)[N+](=O)[O-] |
Product Overview
4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine (CAS 42951-67-7), with molecular formula C8H9N5O2 and molecular weight 207.08 g/mol. IUPAC: 4,6-dimethyl-5-nitro-2H-pyrazolo[3,4-b]pyridin-3-amine.
Chemical Property Profile of 4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine
Property Insights of 4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine
The XLogP value of 1.06514 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine. The TPSA of 110.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine. Following Lipinski's Rule of Five, 4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine 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 4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine?
The CAS number of 4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine is 42951-67-7.
What is the molecular formula of 4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine?
The molecular formula of 4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine is C8H9N5O2.
What is the molecular weight of 4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine?
The molecular weight of 4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine is 207.08 g/mol.
Where can I buy 4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine?
You can request a quote for 4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine?
Yes, KEHONG BIO provides custom synthesis services for 4,6-dimethyl-5-nitro-1H-pyrazolo[3,4-b]pyridin-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.