AB00676286-01
TL;DR: AB00676286-01 (CAS 868966-77-2) is a chemical compound with molecular formula C18H14FN5OS2 and molecular weight 399.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-fluorophenyl)methyl]-2-[(3-thiophen-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide
Also Known As: AB00676286-01, F1835-0063, N-[(4-fluorophenyl)methyl]-2-{[3-(thiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}acetamide, N-(4-fluorobenzyl)-2-((3-(thiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)acetamide, N-[(4-fluorophenyl)methyl]-2-[(3-thiophen-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide
| Molecular Formula | C18H14FN5OS2 |
|---|---|
| Molecular Weight | 399.06 g/mol |
| LogP | 3.4004 |
| Topological Polar Surface Area | 72.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 399.06238 |
| Heavy Atoms | 27 |
| Complexity | 1063.2577 |
Chemical Identifiers
| CAS Number | 868966-77-2 |
|---|---|
| SMILES | C1=CSC(=C1)C2=NN=C3N2N=C(C=C3)SCC(=O)NCC4=CC=C(C=C4)F |
Product Overview
AB00676286-01 (CAS 868966-77-2), with molecular formula C18H14FN5OS2 and molecular weight 399.06 g/mol. IUPAC: N-[(4-fluorophenyl)methyl]-2-[(3-thiophen-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide.
Chemical Property Profile of AB00676286-01
Property Insights of AB00676286-01
The XLogP value of 3.4004 indicates that AB00676286-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.18 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00676286-01. Following Lipinski's Rule of Five, AB00676286-01 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 AB00676286-01?
The CAS number of AB00676286-01 is 868966-77-2.
What is the molecular formula of AB00676286-01?
The molecular formula of AB00676286-01 is C18H14FN5OS2.
What is the molecular weight of AB00676286-01?
The molecular weight of AB00676286-01 is 399.06 g/mol.
Where can I buy AB00676286-01?
You can request a quote for AB00676286-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00676286-01?
Yes, KEHONG BIO provides custom synthesis services for AB00676286-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.