AB00672001-01
TL;DR: AB00672001-01 (CAS 852374-72-2) 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.
2-[[3-(3-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]-N-(3-methoxyphenyl)acetamide
Also Known As: AB00672001-01, F0676-0394, 2-{[3-(3-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide, 2-((3-(3-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)-N-(3-methoxyphenyl)acetamide, 2-[[3-(3-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]-N-(3-methoxyphenyl)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 | 1180.4752 |
Chemical Identifiers
| CAS Number | 852374-72-2 |
|---|---|
| SMILES | COC1=CC=CC(=C1)NC(=O)CSC2=NN3C(=NN=C3C4=CC(=CC=C4)F)C=C2 |
Product Overview
AB00672001-01 (CAS 852374-72-2), with molecular formula C20H16FN5O2S and molecular weight 409.10 g/mol. IUPAC: 2-[[3-(3-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]-N-(3-methoxyphenyl)acetamide.
Chemical Property Profile of AB00672001-01
Property Insights of AB00672001-01
The XLogP value of 3.6698 indicates that AB00672001-01 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 AB00672001-01. Following Lipinski's Rule of Five, AB00672001-01 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 AB00672001-01?
The CAS number of AB00672001-01 is 852374-72-2.
What is the molecular formula of AB00672001-01?
The molecular formula of AB00672001-01 is C20H16FN5O2S.
What is the molecular weight of AB00672001-01?
The molecular weight of AB00672001-01 is 409.10 g/mol.
Where can I buy AB00672001-01?
You can request a quote for AB00672001-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00672001-01?
Yes, KEHONG BIO provides custom synthesis services for AB00672001-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.