AH-487/42277110
TL;DR: AH-487/42277110 (CAS 694485-14-8) is a chemical compound with molecular formula C21H21N3O6S2 and molecular weight 475.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 3-methyl-5-[[2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl]amino]thiophene-2,4-dicarboxylate
Also Known As: AH-487/42277110, diethyl 3-methyl-5-[[2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl]amino]thiophene-2,4-dicarboxylate, diethyl3-methyl-5-({[(5-phenyl-1,3,4-oxadiazol-2-yl)thio]acetyl}amino)-2,4-thiophenedicarboxylate, diethyl 3-methyl-5-({[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl}amino)thiophene-2,4-dicarboxylate, diethyl 3-methyl-5-(2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetamido)thiophene-2,4-dicarboxylate
| Molecular Formula | C21H21N3O6S2 |
|---|---|
| Molecular Weight | 475.09 g/mol |
| LogP | 4.19072 |
| Topological Polar Surface Area | 120.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 475.0872 |
| Heavy Atoms | 32 |
| Complexity | 1110.1953 |
Chemical Identifiers
| CAS Number | 694485-14-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CSC2=NN=C(O2)C3=CC=CC=C3 |
Product Overview
AH-487/42277110 (CAS 694485-14-8), with molecular formula C21H21N3O6S2 and molecular weight 475.09 g/mol. IUPAC: diethyl 3-methyl-5-[[2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl]amino]thiophene-2,4-dicarboxylate.
Chemical Property Profile of AH-487/42277110
Property Insights of AH-487/42277110
The XLogP value of 4.19072 indicates that AH-487/42277110 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.62 Ų falls within the moderate polarity range, balancing permeability and solubility for AH-487/42277110. Following Lipinski's Rule of Five, AH-487/42277110 has 1 hydrogen bond donor(s) and 10 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 AH-487/42277110?
The CAS number of AH-487/42277110 is 694485-14-8.
What is the molecular formula of AH-487/42277110?
The molecular formula of AH-487/42277110 is C21H21N3O6S2.
What is the molecular weight of AH-487/42277110?
The molecular weight of AH-487/42277110 is 475.09 g/mol.
Where can I buy AH-487/42277110?
You can request a quote for AH-487/42277110 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AH-487/42277110?
Yes, KEHONG BIO provides custom synthesis services for AH-487/42277110 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.