CTK4C9939
TL;DR: CTK4C9939 (CAS 159086-08-5) is a chemical compound with molecular formula C26H24N2O4 and molecular weight 428.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-3-(1H-indol-3-yl)propanoate
Also Known As: (E)-N-(5-(2-Furanyl)-3-oxo-4-pentenyl)-L-tryptophan phenyl ester, L-Tryptophan, N-(5-(2-furanyl)-3-oxo-4-pentenyl)-, phenyl ester, (E)-, L-Tryptophan,N-[5-(2-furanyl)-3-oxo-4-pentenyl]-, phenyl ester, (E)- (9CI)
| Molecular Formula | C26H24N2O4 |
|---|---|
| Molecular Weight | 428.17 g/mol |
| LogP | 4.5398 |
| Topological Polar Surface Area | 84.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 428.1736 |
| Heavy Atoms | 32 |
| Complexity | 1193.0475 |
Chemical Identifiers
| CAS Number | 159086-08-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC(=O)[C@H](CC2=CNC3=CC=CC=C32)NCCC(=O)C=CC4=CC=CO4 |
Product Overview
CTK4C9939 (CAS 159086-08-5), with molecular formula C26H24N2O4 and molecular weight 428.17 g/mol. IUPAC: phenyl (2S)-2-[[5-(furan-2-yl)-3-oxopent-4-enyl]amino]-3-(1H-indol-3-yl)propanoate.
Chemical Property Profile of CTK4C9939
Property Insights of CTK4C9939
The XLogP value of 4.5398 indicates that CTK4C9939 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.33 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK4C9939. Following Lipinski's Rule of Five, CTK4C9939 has 2 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 CTK4C9939?
The CAS number of CTK4C9939 is 159086-08-5.
What is the molecular formula of CTK4C9939?
The molecular formula of CTK4C9939 is C26H24N2O4.
What is the molecular weight of CTK4C9939?
The molecular weight of CTK4C9939 is 428.17 g/mol.
Where can I buy CTK4C9939?
You can request a quote for CTK4C9939 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK4C9939?
Yes, KEHONG BIO provides custom synthesis services for CTK4C9939 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.