![2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate structure](/static/products/1356/13560-49-1.webp)
2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate
TL;DR: 2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate (CAS 13560-49-1) is a chemical compound with molecular formula C12H20N2O4S and molecular weight 288.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(3-aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate
Also Known As: Advastab A 70, Thiodiethane-1,2-diyl bis(3-aminobut-2-enoate), Thiodiethylene beta-aminocrotonate, Thiodiglycol bis(3-aminocrotonate), 2,2<<-Thiodiethylbis-(beta-aminocrotonate)
| Molecular Formula | C12H20N2O4S |
|---|---|
| Molecular Weight | 288.11 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 288.11438 |
| Heavy Atoms | 19 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 13560-49-1 |
|---|---|
| SMILES | CC(=CC(=O)OCCSCCOC(=O)C=C(C)N)N |
| InChIKey | GZVBGWRBVGVPLI-UHFFFAOYSA-N |
Product Overview
2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate (CAS 13560-49-1), with molecular formula C12H20N2O4S and molecular weight 288.11 g/mol. IUPAC: 2-[2-(3-aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate.
Chemical Property Profile of 2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate
Property Insights of 2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate. Following Lipinski's Rule of Five, 2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate has 2 hydrogen bond donor(s) and 7 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 2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate?
The CAS number of 2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate is 13560-49-1.
What is the molecular formula of 2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate?
The molecular formula of 2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate is C12H20N2O4S.
What is the molecular weight of 2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate?
The molecular weight of 2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate is 288.11 g/mol.
Where can I buy 2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate?
You can request a quote for 2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(3-Aminobut-2-enoyloxy)ethylsulfanyl]ethyl 3-aminobut-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.