AB00676351-01
TL;DR: AB00676351-01 (CAS 868969-96-4) is a chemical compound with molecular formula C20H16N6O2S and molecular weight 404.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-acetylphenyl)-2-[(3-pyridin-4-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide
Also Known As: AB00676351-01, F1835-0413, N-(4-acetylphenyl)-2-{[3-(pyridin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}acetamide, N-(4-acetylphenyl)-2-((3-(pyridin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)acetamide, N-(4-acetylphenyl)-2-[(3-pyridin-4-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide
| Molecular Formula | C20H16N6O2S |
|---|---|
| Molecular Weight | 404.11 g/mol |
| LogP | 3.1197 |
| Topological Polar Surface Area | 102.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 404.10553 |
| Heavy Atoms | 29 |
| Complexity | 1174.7883 |
Chemical Identifiers
| CAS Number | 868969-96-4 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN3C(=NN=C3C4=CC=NC=C4)C=C2 |
Product Overview
AB00676351-01 (CAS 868969-96-4), with molecular formula C20H16N6O2S and molecular weight 404.11 g/mol. IUPAC: N-(4-acetylphenyl)-2-[(3-pyridin-4-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide.
Chemical Property Profile of AB00676351-01
Property Insights of AB00676351-01
The XLogP value of 3.1197 indicates that AB00676351-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.14 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00676351-01. Following Lipinski's Rule of Five, AB00676351-01 has 1 hydrogen bond donor(s) and 7 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 AB00676351-01?
The CAS number of AB00676351-01 is 868969-96-4.
What is the molecular formula of AB00676351-01?
The molecular formula of AB00676351-01 is C20H16N6O2S.
What is the molecular weight of AB00676351-01?
The molecular weight of AB00676351-01 is 404.11 g/mol.
Where can I buy AB00676351-01?
You can request a quote for AB00676351-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00676351-01?
Yes, KEHONG BIO provides custom synthesis services for AB00676351-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.