AB00676308-01
TL;DR: AB00676308-01 (CAS 868968-16-5) is a chemical compound with molecular formula C17H11Cl2N5S and molecular weight 387.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(2,4-dichlorophenyl)methylsulfanyl]-3-pyridin-2-yl-[1,2,4]triazolo[4,3-b]pyridazine
Also Known As: AB00676308-01, F1835-0219, 2-(6-{[(2,4-dichlorophenyl)methyl]sulfanyl}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)pyridine, 6-((2,4-dichlorobenzyl)thio)-3-(pyridin-2-yl)-[1,2,4]triazolo[4,3-b]pyridazine, 6-[(2,4-dichlorophenyl)methylsulfanyl]-3-pyridin-2-yl-[1,2,4]triazolo[4,3-b]pyridazine
| Molecular Formula | C17H11Cl2N5S |
|---|---|
| Molecular Weight | 387.01 g/mol |
| LogP | 4.7854 |
| Topological Polar Surface Area | 55.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.01123 |
| Heavy Atoms | 25 |
| Complexity | 1035.835 |
Chemical Identifiers
| CAS Number | 868968-16-5 |
|---|---|
| SMILES | C1=CC=NC(=C1)C2=NN=C3N2N=C(C=C3)SCC4=C(C=C(C=C4)Cl)Cl |
Product Overview
AB00676308-01 (CAS 868968-16-5), with molecular formula C17H11Cl2N5S and molecular weight 387.01 g/mol. IUPAC: 6-[(2,4-dichlorophenyl)methylsulfanyl]-3-pyridin-2-yl-[1,2,4]triazolo[4,3-b]pyridazine.
Chemical Property Profile of AB00676308-01
Property Insights of AB00676308-01
The XLogP value of 4.7854 indicates that AB00676308-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.97 Ų, AB00676308-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00676308-01 has 0 hydrogen bond donor(s) and 5 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 AB00676308-01?
The CAS number of AB00676308-01 is 868968-16-5.
What is the molecular formula of AB00676308-01?
The molecular formula of AB00676308-01 is C17H11Cl2N5S.
What is the molecular weight of AB00676308-01?
The molecular weight of AB00676308-01 is 387.01 g/mol.
Where can I buy AB00676308-01?
You can request a quote for AB00676308-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00676308-01?
Yes, KEHONG BIO provides custom synthesis services for AB00676308-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.