AS-871/42392344
TL;DR: AS-871/42392344 (CAS 671799-96-5) is a chemical compound with molecular formula C21H25NO5S and molecular weight 403.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[4-(2-methoxyphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: AS-871/42392344, ethyl 2-[4-(2-methoxyphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-(4-(2-methoxyphenoxy)butanamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-[4-(2-methoxyphenoxy)butanoylamino]-4,5,6-trihydrocyclopenta[2,1-b]thi ophene-3-carboxylate, ethyl 2-{[4-(2-methoxyphenoxy)butanoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
| Molecular Formula | C21H25NO5S |
|---|---|
| Molecular Weight | 403.15 g/mol |
| LogP | 4.2198 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 403.14536 |
| Heavy Atoms | 28 |
| Complexity | 845.31665 |
Chemical Identifiers
| CAS Number | 671799-96-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)CCCOC3=CC=CC=C3OC |
Product Overview
AS-871/42392344 (CAS 671799-96-5), with molecular formula C21H25NO5S and molecular weight 403.15 g/mol. IUPAC: ethyl 2-[4-(2-methoxyphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of AS-871/42392344
Property Insights of AS-871/42392344
The XLogP value of 4.2198 indicates that AS-871/42392344 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/42392344. Following Lipinski's Rule of Five, AS-871/42392344 has 1 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 AS-871/42392344?
The CAS number of AS-871/42392344 is 671799-96-5.
What is the molecular formula of AS-871/42392344?
The molecular formula of AS-871/42392344 is C21H25NO5S.
What is the molecular weight of AS-871/42392344?
The molecular weight of AS-871/42392344 is 403.15 g/mol.
Where can I buy AS-871/42392344?
You can request a quote for AS-871/42392344 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/42392344?
Yes, KEHONG BIO provides custom synthesis services for AS-871/42392344 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.