AP-853/43261266
TL;DR: AP-853/43261266 (CAS 825610-71-7) is a chemical compound with molecular formula C16H19N3O3S4 and molecular weight 429.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: AP-853/43261266, ethyl 2-[({[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-[[2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-(2-((3-(methylthio)-1,2,4-thiadiazol-5-yl)thio)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ETHYL 2-(2-{[3-(METHYLSULFANYL)-1,2,4-THIADIAZOL-5-YL]SULFANYL}ACETAMIDO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE
| Molecular Formula | C16H19N3O3S4 |
|---|---|
| Molecular Weight | 429.03 g/mol |
| LogP | 4.1078 |
| Topological Polar Surface Area | 81.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 429.0309 |
| Heavy Atoms | 26 |
| Complexity | 802.7603 |
Chemical Identifiers
| CAS Number | 825610-71-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSC3=NC(=NS3)SC |
Product Overview
AP-853/43261266 (CAS 825610-71-7), with molecular formula C16H19N3O3S4 and molecular weight 429.03 g/mol. IUPAC: ethyl 2-[[2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of AP-853/43261266
Property Insights of AP-853/43261266
The XLogP value of 4.1078 indicates that AP-853/43261266 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.18 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-853/43261266. Following Lipinski's Rule of Five, AP-853/43261266 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 AP-853/43261266?
The CAS number of AP-853/43261266 is 825610-71-7.
What is the molecular formula of AP-853/43261266?
The molecular formula of AP-853/43261266 is C16H19N3O3S4.
What is the molecular weight of AP-853/43261266?
The molecular weight of AP-853/43261266 is 429.03 g/mol.
Where can I buy AP-853/43261266?
You can request a quote for AP-853/43261266 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-853/43261266?
Yes, KEHONG BIO provides custom synthesis services for AP-853/43261266 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.