F0676-0180
TL;DR: F0676-0180 (CAS 852373-39-8) is a chemical compound with molecular formula C17H16ClN5O3S and molecular weight 405.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[[3-(4-chlorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]acetyl]amino]acetate
Also Known As: F0676-0180, ethyl 2-(2-((3-(4-chlorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)acetamido)acetate, ethyl 2-(2-{[3-(4-chlorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}acetamido)acetate, ethyl 2-[[2-[[3-(4-chlorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]acetyl]amino]acetate, ethyl ({[3-(p-chlorophenyl)-1,2,3a,4-tetraaza-5-indenylthio]methyl}carbonylamino)acetate
| Molecular Formula | C17H16ClN5O3S |
|---|---|
| Molecular Weight | 405.07 g/mol |
| LogP | 2.2161 |
| Topological Polar Surface Area | 98.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 405.06622 |
| Heavy Atoms | 27 |
| Complexity | 960.8622 |
Chemical Identifiers
| CAS Number | 852373-39-8 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)CSC1=NN2C(=NN=C2C3=CC=C(C=C3)Cl)C=C1 |
Product Overview
F0676-0180 (CAS 852373-39-8), with molecular formula C17H16ClN5O3S and molecular weight 405.07 g/mol. IUPAC: ethyl 2-[[2-[[3-(4-chlorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]acetyl]amino]acetate.
Chemical Property Profile of F0676-0180
Property Insights of F0676-0180
The XLogP value of 2.2161 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0676-0180. The TPSA of 98.48 Ų falls within the moderate polarity range, balancing permeability and solubility for F0676-0180. Following Lipinski's Rule of Five, F0676-0180 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 F0676-0180?
The CAS number of F0676-0180 is 852373-39-8.
What is the molecular formula of F0676-0180?
The molecular formula of F0676-0180 is C17H16ClN5O3S.
What is the molecular weight of F0676-0180?
The molecular weight of F0676-0180 is 405.07 g/mol.
Where can I buy F0676-0180?
You can request a quote for F0676-0180 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0676-0180?
Yes, KEHONG BIO provides custom synthesis services for F0676-0180 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.