![butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate structure](/static/products/1590/159086-06-3.webp)
butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate
TL;DR: butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate (CAS 159086-06-3) is a chemical compound with molecular formula C18H27NO4S and molecular weight 353.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate
Also Known As: N-((4E)-5-(2-Furanyl)-3-oxo-4-pentenyl)-L-methionine butyl ester, L-Methionine, N-((4E)-5-(2-furanyl)-3-oxo-4-pentenyl)-, butyl ester, L-Methionine,N-[(4E)-5-(2-furanyl)-3-oxo-4-penten-1-yl]-, butyl ester
| Molecular Formula | C18H27NO4S |
|---|---|
| Molecular Weight | 353.17 g/mol |
| LogP | 3.3066 |
| Topological Polar Surface Area | 68.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 353.16608 |
| Heavy Atoms | 24 |
| Complexity | 499.12686 |
Chemical Identifiers
| CAS Number | 159086-06-3 |
|---|---|
| SMILES | CCCCOC(=O)[C@H](CCSC)NCCC(=O)C=CC1=CC=CO1 |
Product Overview
butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate (CAS 159086-06-3), with molecular formula C18H27NO4S and molecular weight 353.17 g/mol. IUPAC: butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate.
Chemical Property Profile of butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate
Property Insights of butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate
The XLogP value of 3.3066 indicates that butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.54 Ų falls within the moderate polarity range, balancing permeability and solubility for butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate. Following Lipinski's Rule of Five, butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate has 1 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 butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate?
The CAS number of butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate is 159086-06-3.
What is the molecular formula of butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate?
The molecular formula of butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate is C18H27NO4S.
What is the molecular weight of butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate?
The molecular weight of butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate is 353.17 g/mol.
Where can I buy butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate?
You can request a quote for butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate?
Yes, KEHONG BIO provides custom synthesis services for butyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-4-methylsulfanylbutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.