F2007-0228
TL;DR: F2007-0228 (CAS 872995-39-6) is a chemical compound with molecular formula C17H16N6OS and molecular weight 352.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[6-(cyanomethylsulfanyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]ethyl]-4-methylbenzamide
Also Known As: F2007-0228, N-(2-(6-((cyanomethyl)thio)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl)-4-methylbenzamide, N-[2-[6-(cyanomethylsulfanyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]ethyl]-4-methylbenzamide, N-(2-{6-[(cyanomethyl)sulfanyl]-[1,2,4]triazolo[4,3-b]pyridazin-3-yl}ethyl)-4-methylbenzamide, N-{2-[5-(cyanomethylthio)-1,2,3a,4-tetraaza-3-indenyl]ethyl}-p-toluamide
| Molecular Formula | C17H16N6OS |
|---|---|
| Molecular Weight | 352.11 g/mol |
| LogP | 2.0209 |
| Topological Polar Surface Area | 95.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 352.11063 |
| Heavy Atoms | 25 |
| Complexity | 928.45624 |
Chemical Identifiers
| CAS Number | 872995-39-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NCCC2=NN=C3N2N=C(C=C3)SCC#N |
Product Overview
F2007-0228 (CAS 872995-39-6), with molecular formula C17H16N6OS and molecular weight 352.11 g/mol. IUPAC: N-[2-[6-(cyanomethylsulfanyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]ethyl]-4-methylbenzamide.
Chemical Property Profile of F2007-0228
Property Insights of F2007-0228
The XLogP value of 2.0209 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2007-0228. The TPSA of 95.97 Ų falls within the moderate polarity range, balancing permeability and solubility for F2007-0228. Following Lipinski's Rule of Five, F2007-0228 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 F2007-0228?
The CAS number of F2007-0228 is 872995-39-6.
What is the molecular formula of F2007-0228?
The molecular formula of F2007-0228 is C17H16N6OS.
What is the molecular weight of F2007-0228?
The molecular weight of F2007-0228 is 352.11 g/mol.
Where can I buy F2007-0228?
You can request a quote for F2007-0228 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2007-0228?
Yes, KEHONG BIO provides custom synthesis services for F2007-0228 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.