AB00678527-01
TL;DR: AB00678527-01 (CAS 891095-32-2) is a chemical compound with molecular formula C20H16FN5O2S and molecular weight 409.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-fluorophenyl)-2-[[6-(3-methoxyphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl]acetamide
Also Known As: AB00678527-01, F2506-1300, N-(4-fluorophenyl)-2-{[6-(3-methoxyphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}acetamide, N-(4-fluorophenyl)-2-((6-(3-methoxyphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)thio)acetamide, N-(4-fluorophenyl)-2-[[6-(3-methoxyphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl]acetamide
| Molecular Formula | C20H16FN5O2S |
|---|---|
| Molecular Weight | 409.10 g/mol |
| LogP | 3.6698 |
| Topological Polar Surface Area | 81.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 409.10086 |
| Heavy Atoms | 29 |
| Complexity | 1163.2252 |
Chemical Identifiers
| CAS Number | 891095-32-2 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C2=NN3C(=NN=C3SCC(=O)NC4=CC=C(C=C4)F)C=C2 |
Product Overview
AB00678527-01 (CAS 891095-32-2), with molecular formula C20H16FN5O2S and molecular weight 409.10 g/mol. IUPAC: N-(4-fluorophenyl)-2-[[6-(3-methoxyphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl]acetamide.
Chemical Property Profile of AB00678527-01
Property Insights of AB00678527-01
The XLogP value of 3.6698 indicates that AB00678527-01 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 AB00678527-01. Following Lipinski's Rule of Five, AB00678527-01 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 AB00678527-01?
The CAS number of AB00678527-01 is 891095-32-2.
What is the molecular formula of AB00678527-01?
The molecular formula of AB00678527-01 is C20H16FN5O2S.
What is the molecular weight of AB00678527-01?
The molecular weight of AB00678527-01 is 409.10 g/mol.
Where can I buy AB00678527-01?
You can request a quote for AB00678527-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00678527-01?
Yes, KEHONG BIO provides custom synthesis services for AB00678527-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.