F0676-0936
TL;DR: F0676-0936 (CAS 852437-96-8) is a chemical compound with molecular formula C17H18N4O4S and molecular weight 374.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[3-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]acetate
Also Known As: F0676-0936, ethyl 2-((3-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)acetate, ethyl 2-[[3-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]acetate, ethyl 2-{[3-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}acetate
| Molecular Formula | C17H18N4O4S |
|---|---|
| Molecular Weight | 374.10 g/mol |
| LogP | 2.4637 |
| Topological Polar Surface Area | 87.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 374.1049 |
| Heavy Atoms | 26 |
| Complexity | 928.2669 |
Chemical Identifiers
| CAS Number | 852437-96-8 |
|---|---|
| SMILES | CCOC(=O)CSC1=NN2C(=NN=C2C3=CC(=C(C=C3)OC)OC)C=C1 |
Product Overview
F0676-0936 (CAS 852437-96-8), with molecular formula C17H18N4O4S and molecular weight 374.10 g/mol. IUPAC: ethyl 2-[[3-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]acetate.
Chemical Property Profile of F0676-0936
Property Insights of F0676-0936
The XLogP value of 2.4637 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0676-0936. The TPSA of 87.84 Ų falls within the moderate polarity range, balancing permeability and solubility for F0676-0936. Following Lipinski's Rule of Five, F0676-0936 has 0 hydrogen bond donor(s) and 8 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 F0676-0936?
The CAS number of F0676-0936 is 852437-96-8.
What is the molecular formula of F0676-0936?
The molecular formula of F0676-0936 is C17H18N4O4S.
What is the molecular weight of F0676-0936?
The molecular weight of F0676-0936 is 374.10 g/mol.
Where can I buy F0676-0936?
You can request a quote for F0676-0936 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0676-0936?
Yes, KEHONG BIO provides custom synthesis services for F0676-0936 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.