F2007-0316
TL;DR: F2007-0316 (CAS 872996-16-2) is a chemical compound with molecular formula C22H21N5O2S and molecular weight 419.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(6-benzylsulfanyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl]-4-methoxybenzamide
Also Known As: F2007-0316, N-{2-[6-(benzylsulfanyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]ethyl}-4-methoxybenzamide, N-(2-(6-(benzylthio)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl)-4-methoxybenzamide, N-[2-(6-benzylsulfanyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl]-4-methoxybenzamide
| Molecular Formula | C22H21N5O2S |
|---|---|
| Molecular Weight | 419.14 g/mol |
| LogP | 3.3977 |
| Topological Polar Surface Area | 81.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 419.1416 |
| Heavy Atoms | 30 |
| Complexity | 1129.454 |
Chemical Identifiers
| CAS Number | 872996-16-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)NCCC2=NN=C3N2N=C(C=C3)SCC4=CC=CC=C4 |
Product Overview
F2007-0316 (CAS 872996-16-2), with molecular formula C22H21N5O2S and molecular weight 419.14 g/mol. IUPAC: N-[2-(6-benzylsulfanyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl]-4-methoxybenzamide.
Chemical Property Profile of F2007-0316
Property Insights of F2007-0316
The XLogP value of 3.3977 indicates that F2007-0316 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.41 Ų falls within the moderate polarity range, balancing permeability and solubility for F2007-0316. Following Lipinski's Rule of Five, F2007-0316 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 F2007-0316?
The CAS number of F2007-0316 is 872996-16-2.
What is the molecular formula of F2007-0316?
The molecular formula of F2007-0316 is C22H21N5O2S.
What is the molecular weight of F2007-0316?
The molecular weight of F2007-0316 is 419.14 g/mol.
Where can I buy F2007-0316?
You can request a quote for F2007-0316 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2007-0316?
Yes, KEHONG BIO provides custom synthesis services for F2007-0316 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.