AB00671939-01
TL;DR: AB00671939-01 (CAS 852373-63-8) is a chemical compound with molecular formula C20H15ClN4O2S and molecular weight 410.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-(4-chlorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]-1-(4-methoxyphenyl)ethanone
Also Known As: AB00671939-01, 2-((3-(4-chlorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)-1-(4-methoxyphenyl)ethanone, F0676-0238, 2-[[3-(4-chlorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]-1-(4-methoxyphenyl)ethanone, 2-{[3-(4-chlorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}-1-(4-methoxyphenyl)ethan-1-one
| Molecular Formula | C20H15ClN4O2S |
|---|---|
| Molecular Weight | 410.06 g/mol |
| LogP | 4.4283 |
| Topological Polar Surface Area | 69.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 410.06042 |
| Heavy Atoms | 28 |
| Complexity | 1127.377 |
Chemical Identifiers
| CAS Number | 852373-63-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)CSC2=NN3C(=NN=C3C4=CC=C(C=C4)Cl)C=C2 |
Product Overview
AB00671939-01 (CAS 852373-63-8), with molecular formula C20H15ClN4O2S and molecular weight 410.06 g/mol. IUPAC: 2-[[3-(4-chlorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]-1-(4-methoxyphenyl)ethanone.
Chemical Property Profile of AB00671939-01
Property Insights of AB00671939-01
The XLogP value of 4.4283 indicates that AB00671939-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.38 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00671939-01. Following Lipinski's Rule of Five, AB00671939-01 has 0 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 AB00671939-01?
The CAS number of AB00671939-01 is 852373-63-8.
What is the molecular formula of AB00671939-01?
The molecular formula of AB00671939-01 is C20H15ClN4O2S.
What is the molecular weight of AB00671939-01?
The molecular weight of AB00671939-01 is 410.06 g/mol.
Where can I buy AB00671939-01?
You can request a quote for AB00671939-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00671939-01?
Yes, KEHONG BIO provides custom synthesis services for AB00671939-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.