AS-871/15339391
TL;DR: AS-871/15339391 (CAS 329226-47-3) is a chemical compound with molecular formula C17H25NO4S and molecular weight 339.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(butoxycarbonylamino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: AS-871/15339391, ethyl 2-[(butoxycarbonyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-((butoxycarbonyl)amino)-6-methyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ethyl 2-(butoxycarbonylamino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-(butoxycarbonylamino)-6-methyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-c arboxylate
| Molecular Formula | C17H25NO4S |
|---|---|
| Molecular Weight | 339.15 g/mol |
| LogP | 4.3982 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 339.15042 |
| Heavy Atoms | 23 |
| Complexity | 567.18475 |
Chemical Identifiers
| CAS Number | 329226-47-3 |
|---|---|
| SMILES | CCCCOC(=O)NC1=C(C2=C(S1)CC(CC2)C)C(=O)OCC |
Product Overview
AS-871/15339391 (CAS 329226-47-3), with molecular formula C17H25NO4S and molecular weight 339.15 g/mol. IUPAC: ethyl 2-(butoxycarbonylamino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of AS-871/15339391
Property Insights of AS-871/15339391
The XLogP value of 4.3982 indicates that AS-871/15339391 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/15339391. Following Lipinski's Rule of Five, AS-871/15339391 has 1 hydrogen bond donor(s) and 5 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-871/15339391?
The CAS number of AS-871/15339391 is 329226-47-3.
What is the molecular formula of AS-871/15339391?
The molecular formula of AS-871/15339391 is C17H25NO4S.
What is the molecular weight of AS-871/15339391?
The molecular weight of AS-871/15339391 is 339.15 g/mol.
Where can I buy AS-871/15339391?
You can request a quote for AS-871/15339391 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/15339391?
Yes, KEHONG BIO provides custom synthesis services for AS-871/15339391 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.