AB00676296-01
TL;DR: AB00676296-01 (CAS 868967-40-2) is a chemical compound with molecular formula C18H13FN6OS and molecular weight 380.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-fluorophenyl)-2-[(3-pyridin-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide
Also Known As: AB00676296-01, F1835-0146, N-(3-fluorophenyl)-2-{[3-(pyridin-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}acetamide, N-(3-fluorophenyl)-2-((3-(pyridin-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)acetamide, N-(3-fluorophenyl)-2-[(3-pyridin-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide
| Molecular Formula | C18H13FN6OS |
|---|---|
| Molecular Weight | 380.09 g/mol |
| LogP | 3.0562 |
| Topological Polar Surface Area | 85.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.08557 |
| Heavy Atoms | 27 |
| Complexity | 1101.421 |
Chemical Identifiers
| CAS Number | 868967-40-2 |
|---|---|
| SMILES | C1=CC=NC(=C1)C2=NN=C3N2N=C(C=C3)SCC(=O)NC4=CC(=CC=C4)F |
Product Overview
AB00676296-01 (CAS 868967-40-2), with molecular formula C18H13FN6OS and molecular weight 380.09 g/mol. IUPAC: N-(3-fluorophenyl)-2-[(3-pyridin-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide.
Chemical Property Profile of AB00676296-01
Property Insights of AB00676296-01
The XLogP value of 3.0562 indicates that AB00676296-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.07 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00676296-01. Following Lipinski's Rule of Five, AB00676296-01 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 AB00676296-01?
The CAS number of AB00676296-01 is 868967-40-2.
What is the molecular formula of AB00676296-01?
The molecular formula of AB00676296-01 is C18H13FN6OS.
What is the molecular weight of AB00676296-01?
The molecular weight of AB00676296-01 is 380.09 g/mol.
Where can I buy AB00676296-01?
You can request a quote for AB00676296-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00676296-01?
Yes, KEHONG BIO provides custom synthesis services for AB00676296-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.