AP-064/40657034
TL;DR: AP-064/40657034 (CAS 433700-18-6) is a chemical compound with molecular formula C23H26N2O6S and molecular weight 458.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[3-[(4-ethoxycarbonylphenyl)carbamoyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]amino]-4-oxobutanoic acid
Also Known As: AP-064/40657034, 4-[(3-{[4-(ethoxycarbonyl)anilino]carbonyl}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)amino]-4-oxobutanoic acid, 4-[[3-[(4-ethoxycarbonylphenyl)carbamoyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]amino]-4-oxobutanoic acid, 4-((3-((4-(ethoxycarbonyl)phenyl)carbamoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino)-4-oxobutanoic acid, 4-{[3-({[4-(ethoxycarbonyl)phenyl]amino}carbonyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl]amino}-4-oxobutanoic acid
| Molecular Formula | C23H26N2O6S |
|---|---|
| Molecular Weight | 458.15 g/mol |
| LogP | 4.2493 |
| Topological Polar Surface Area | 121.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 458.15115 |
| Heavy Atoms | 32 |
| Complexity | 1012.2391 |
Chemical Identifiers
| CAS Number | 433700-18-6 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCCCC3)NC(=O)CCC(=O)O |
Product Overview
AP-064/40657034 (CAS 433700-18-6), with molecular formula C23H26N2O6S and molecular weight 458.15 g/mol. IUPAC: 4-[[3-[(4-ethoxycarbonylphenyl)carbamoyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]amino]-4-oxobutanoic acid.
Chemical Property Profile of AP-064/40657034
Property Insights of AP-064/40657034
The XLogP value of 4.2493 indicates that AP-064/40657034 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.8 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-064/40657034. Following Lipinski's Rule of Five, AP-064/40657034 has 3 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 AP-064/40657034?
The CAS number of AP-064/40657034 is 433700-18-6.
What is the molecular formula of AP-064/40657034?
The molecular formula of AP-064/40657034 is C23H26N2O6S.
What is the molecular weight of AP-064/40657034?
The molecular weight of AP-064/40657034 is 458.15 g/mol.
Where can I buy AP-064/40657034?
You can request a quote for AP-064/40657034 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-064/40657034?
Yes, KEHONG BIO provides custom synthesis services for AP-064/40657034 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.