RefChem:567196
TL;DR: RefChem:567196 (CAS 68083-29-4) is a chemical compound with molecular formula C16H24N2O5 and molecular weight 324.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[5-acetamido-N-(2-hydroxyethyl)-2-methoxyanilino]propanoate
Also Known As: 3-((2-Hydroxyethyl)(5-acetamido-2-methoxyphenyl)amino)propionic acid, ethyl ester, .beta.-Alanine, N-[5-(acetylamino)-2-methoxyphenyl]-N-(2-hydroxyethyl)-, ethyl ester, beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-N-(2-hydroxyethyl)-, ethyl ester, ethyl N-[5-(acetylamino)-2-methoxyphenyl]-N-(2-hydroxyethyl)-beta-alaninate, beta-Alanine, N-[5-(acetylamino)-2-methoxyphenyl]-N-(2-hydroxyethyl)-, ethyl ester
| Molecular Formula | C16H24N2O5 |
|---|---|
| Molecular Weight | 324.17 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 88.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 324.16852 |
| Heavy Atoms | 23 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 68083-29-4 |
|---|---|
| SMILES | CCOC(=O)CCN(CCO)C1=C(C=CC(=C1)NC(=O)C)OC |
| InChIKey | ARIQQHZBLXZETR-UHFFFAOYSA-N |
Product Overview
RefChem:567196 (CAS 68083-29-4), with molecular formula C16H24N2O5 and molecular weight 324.17 g/mol. IUPAC: ethyl 3-[5-acetamido-N-(2-hydroxyethyl)-2-methoxyanilino]propanoate.
Chemical Property Profile of RefChem:567196
Property Insights of RefChem:567196
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:567196. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:567196. Following Lipinski's Rule of Five, RefChem:567196 has 2 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 RefChem:567196?
The CAS number of RefChem:567196 is 68083-29-4.
What is the molecular formula of RefChem:567196?
The molecular formula of RefChem:567196 is C16H24N2O5.
What is the molecular weight of RefChem:567196?
The molecular weight of RefChem:567196 is 324.17 g/mol.
Where can I buy RefChem:567196?
You can request a quote for RefChem:567196 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:567196?
Yes, KEHONG BIO provides custom synthesis services for RefChem:567196 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.