F0679-0630
TL;DR: F0679-0630 (CAS 863447-99-8) is a chemical compound with molecular formula C20H23N5O4 and molecular weight 397.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-(1-tert-butyl-4-oxopyrazolo[5,4-d]pyrimidin-5-yl)acetyl]amino]benzoate
Also Known As: F0679-0630, ethyl 4-(2-{1-tert-butyl-4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-5-yl}acetamido)benzoate, ethyl 4-(2-(1-(tert-butyl)-4-oxo-1H-pyrazolo[3,4-d]pyrimidin-5(4H)-yl)acetamido)benzoate, ethyl 4-[[2-(1-tert-butyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)acetyl]amino]benzoate
| Molecular Formula | C20H23N5O4 |
|---|---|
| Molecular Weight | 397.18 g/mol |
| LogP | 2.1634 |
| Topological Polar Surface Area | 108.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 397.17502 |
| Heavy Atoms | 29 |
| Complexity | 1106.5874 |
Chemical Identifiers
| CAS Number | 863447-99-8 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C=NN3C(C)(C)C |
Product Overview
F0679-0630 (CAS 863447-99-8), with molecular formula C20H23N5O4 and molecular weight 397.18 g/mol. IUPAC: ethyl 4-[[2-(1-tert-butyl-4-oxopyrazolo[5,4-d]pyrimidin-5-yl)acetyl]amino]benzoate.
Chemical Property Profile of F0679-0630
Property Insights of F0679-0630
The XLogP value of 2.1634 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0679-0630. The TPSA of 108.11 Ų falls within the moderate polarity range, balancing permeability and solubility for F0679-0630. Following Lipinski's Rule of Five, F0679-0630 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 F0679-0630?
The CAS number of F0679-0630 is 863447-99-8.
What is the molecular formula of F0679-0630?
The molecular formula of F0679-0630 is C20H23N5O4.
What is the molecular weight of F0679-0630?
The molecular weight of F0679-0630 is 397.18 g/mol.
Where can I buy F0679-0630?
You can request a quote for F0679-0630 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0679-0630?
Yes, KEHONG BIO provides custom synthesis services for F0679-0630 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.