F0679-0167
TL;DR: F0679-0167 (CAS 863446-71-3) is a chemical compound with molecular formula C20H16N6O4 and molecular weight 404.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(4-methylphenyl)-4-oxopyrazolo[5,4-d]pyrimidin-5-yl]-N-(3-nitrophenyl)acetamide
Also Known As: F0679-0167, 2-[1-(4-methylphenyl)-4-oxopyrazolo[3,4-d]pyrimidin-5-yl]-N-(3-nitrophenyl)acetamide, N-(3-nitrophenyl)-2-(4-oxo-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidin-5(4H)-yl)acetamide, 2-[1-(4-methylphenyl)-4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-5-yl]-N-(3-nitrophenyl)acetamide
| Molecular Formula | C20H16N6O4 |
|---|---|
| Molecular Weight | 404.12 g/mol |
| LogP | 2.43752 |
| Topological Polar Surface Area | 124.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 404.1233 |
| Heavy Atoms | 30 |
| Complexity | 1323.3868 |
Chemical Identifiers
| CAS Number | 863446-71-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C3=C(C=N2)C(=O)N(C=N3)CC(=O)NC4=CC(=CC=C4)[N+](=O)[O-] |
Product Overview
F0679-0167 (CAS 863446-71-3), with molecular formula C20H16N6O4 and molecular weight 404.12 g/mol. IUPAC: 2-[1-(4-methylphenyl)-4-oxopyrazolo[5,4-d]pyrimidin-5-yl]-N-(3-nitrophenyl)acetamide.
Chemical Property Profile of F0679-0167
Property Insights of F0679-0167
The XLogP value of 2.43752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0679-0167. The TPSA of 124.95 Ų falls within the moderate polarity range, balancing permeability and solubility for F0679-0167. Following Lipinski's Rule of Five, F0679-0167 has 1 hydrogen bond donor(s) and 6 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 F0679-0167?
The CAS number of F0679-0167 is 863446-71-3.
What is the molecular formula of F0679-0167?
The molecular formula of F0679-0167 is C20H16N6O4.
What is the molecular weight of F0679-0167?
The molecular weight of F0679-0167 is 404.12 g/mol.
Where can I buy F0679-0167?
You can request a quote for F0679-0167 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0679-0167?
Yes, KEHONG BIO provides custom synthesis services for F0679-0167 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.