AS-871/42093805
TL;DR: AS-871/42093805 (CAS 577962-46-0) is a chemical compound with molecular formula C23H19N5O6S and molecular weight 493.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3Z)-2-oxo-3-[6-oxo-2-(3,4,5-trimethoxyphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-ylidene]indol-1-yl]acetamide
Also Known As: AS-871/42093805, 2-{(3Z)-2-oxo-3-[6-oxo-2-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-2,3-dihydro-1H-indol-1-yl}acetamide, (Z)-2-(2-oxo-3-(6-oxo-2-(3,4,5-trimethoxyphenyl)thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)indolin-1-yl)acetamide, 2-[(3Z)-2-oxo-3-[6-oxo-2-(3,4,5-trimethoxyphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-ylidene]indol-1-yl]acetamide, 2-[2-oxo-3-(6-oxo-2-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)-2,3-dihydro-1H-indol-1-yl]acetamide
| Molecular Formula | C23H19N5O6S |
|---|---|
| Molecular Weight | 493.11 g/mol |
| LogP | 0.5936 |
| Topological Polar Surface Area | 138.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 493.1056 |
| Heavy Atoms | 35 |
| Complexity | 1600.052 |
Chemical Identifiers
| CAS Number | 577962-46-0 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C2=NN3C(=O)/C(=C/4\C5=CC=CC=C5N(C4=O)CC(=O)N)/SC3=N2 |
Product Overview
AS-871/42093805 (CAS 577962-46-0), with molecular formula C23H19N5O6S and molecular weight 493.11 g/mol. IUPAC: 2-[(3Z)-2-oxo-3-[6-oxo-2-(3,4,5-trimethoxyphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-ylidene]indol-1-yl]acetamide.
Chemical Property Profile of AS-871/42093805
Property Insights of AS-871/42093805
The XLogP value of 0.5936 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AS-871/42093805. The TPSA of 138.35 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/42093805. Following Lipinski's Rule of Five, AS-871/42093805 has 1 hydrogen bond donor(s) and 9 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 AS-871/42093805?
The CAS number of AS-871/42093805 is 577962-46-0.
What is the molecular formula of AS-871/42093805?
The molecular formula of AS-871/42093805 is C23H19N5O6S.
What is the molecular weight of AS-871/42093805?
The molecular weight of AS-871/42093805 is 493.11 g/mol.
Where can I buy AS-871/42093805?
You can request a quote for AS-871/42093805 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/42093805?
Yes, KEHONG BIO provides custom synthesis services for AS-871/42093805 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.