Ethyl 2-amino-3-decylsulfanylpropanoate
TL;DR: Ethyl 2-amino-3-decylsulfanylpropanoate (CAS 61786-59-2) is a chemical compound with molecular formula C15H31NO2S and molecular weight 289.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-amino-3-decylsulfanylpropanoate
Also Known As: Ethyl S-decylcysteinate, ethyl 2-amino-3-decylsulfanylpropanoate, ETHYL 2-AMINO-3-DECYLSULFANYL-PROPANOATE
| Molecular Formula | C15H31NO2S |
|---|---|
| Molecular Weight | 289.21 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 77.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 289.20755 |
| Heavy Atoms | 19 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 61786-59-2 |
|---|---|
| SMILES | CCCCCCCCCCSCC(C(=O)OCC)N |
| InChIKey | FNEQFXSVXDLGJT-UHFFFAOYSA-N |
Product Overview
Ethyl 2-amino-3-decylsulfanylpropanoate (CAS 61786-59-2), with molecular formula C15H31NO2S and molecular weight 289.21 g/mol. IUPAC: ethyl 2-amino-3-decylsulfanylpropanoate.
Chemical Property Profile of Ethyl 2-amino-3-decylsulfanylpropanoate
Property Insights of Ethyl 2-amino-3-decylsulfanylpropanoate
The XLogP value of 4.8 indicates that Ethyl 2-amino-3-decylsulfanylpropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-amino-3-decylsulfanylpropanoate. Following Lipinski's Rule of Five, Ethyl 2-amino-3-decylsulfanylpropanoate has 1 hydrogen bond donor(s) and 4 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 Ethyl 2-amino-3-decylsulfanylpropanoate?
The CAS number of Ethyl 2-amino-3-decylsulfanylpropanoate is 61786-59-2.
What is the molecular formula of Ethyl 2-amino-3-decylsulfanylpropanoate?
The molecular formula of Ethyl 2-amino-3-decylsulfanylpropanoate is C15H31NO2S.
What is the molecular weight of Ethyl 2-amino-3-decylsulfanylpropanoate?
The molecular weight of Ethyl 2-amino-3-decylsulfanylpropanoate is 289.21 g/mol.
Where can I buy Ethyl 2-amino-3-decylsulfanylpropanoate?
You can request a quote for Ethyl 2-amino-3-decylsulfanylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-amino-3-decylsulfanylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-amino-3-decylsulfanylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.