![ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate structure](/static/products/1008/1008038-82-1.webp)
ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate
TL;DR: ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate (CAS 1008038-82-1) is a chemical compound with molecular formula C21H23N3O5 and molecular weight 397.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[[[2-acetamido-3-(1H-indol-3-yl)propanoyl]amino]methyl]furan-2-carboxylate
Also Known As: AO-080/42479280, ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate, ethyl 5-((2-acetamido-3-(1H-indol-3-yl)propanamido)methyl)furan-2-carboxylate, ethyl 5-({[2-(acetylamino)-3-(1H-indol-3-yl)propanoyl]amino}methyl)-2-furoate, ethyl 5-[[[2-acetamido-3-(1H-indol-3-yl)propanoyl]amino]methyl]furan-2-carboxylate
| Molecular Formula | C21H23N3O5 |
|---|---|
| Molecular Weight | 397.16 g/mol |
| LogP | 2.3012 |
| Topological Polar Surface Area | 113.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 397.16376 |
| Heavy Atoms | 29 |
| Complexity | 1020.18005 |
Chemical Identifiers
| CAS Number | 1008038-82-1 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(O1)CNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C |
Product Overview
ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate (CAS 1008038-82-1), with molecular formula C21H23N3O5 and molecular weight 397.16 g/mol. IUPAC: ethyl 5-[[[2-acetamido-3-(1H-indol-3-yl)propanoyl]amino]methyl]furan-2-carboxylate.
Chemical Property Profile of ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate
Property Insights of ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate
The XLogP value of 2.3012 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate. The TPSA of 113.43 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate. Following Lipinski's Rule of Five, ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate has 3 hydrogen bond donor(s) and 5 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 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate?
The CAS number of ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate is 1008038-82-1.
What is the molecular formula of ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate?
The molecular formula of ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate is C21H23N3O5.
What is the molecular weight of ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate?
The molecular weight of ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate is 397.16 g/mol.
Where can I buy ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate?
You can request a quote for ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-{[(N-acetyltryptophyl)amino]methyl}-2-furoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.