CTK4E2894
TL;DR: CTK4E2894 (CAS 1997-60-0) is a chemical compound with molecular formula C24H25FN4O3 and molecular weight 436.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-amino-3-(5-fluoro-1H-indol-3-yl)propanoyl]amino]-3-(1H-indol-3-yl)propanoate
Also Known As: Ethyl 5-fluorotryptophyltryptophanate, ethyl 2-[[2-amino-3-(5-fluoro-1H-indol-3-yl)propanoyl]amino]-3-(1H-indol-3-yl)propanoate, Tryptophan,N-(5-fluoro-DL-tryptophyl)-, ethyl ester, monohydrochloride, DL- (8CI)
| Molecular Formula | C24H25FN4O3 |
|---|---|
| Molecular Weight | 436.19 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 436.19107 |
| Heavy Atoms | 32 |
| Complexity | 665.0 |
Chemical Identifiers
| CAS Number | 1997-60-0 |
|---|---|
| SMILES | CCOC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C(CC3=CNC4=C3C=C(C=C4)F)N |
| InChIKey | OFSFTCDLDIRDOM-UHFFFAOYSA-N |
Product Overview
CTK4E2894 (CAS 1997-60-0), with molecular formula C24H25FN4O3 and molecular weight 436.19 g/mol. IUPAC: ethyl 2-[[2-amino-3-(5-fluoro-1H-indol-3-yl)propanoyl]amino]-3-(1H-indol-3-yl)propanoate.
Chemical Property Profile of CTK4E2894
Property Insights of CTK4E2894
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK4E2894. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK4E2894. Following Lipinski's Rule of Five, CTK4E2894 has 4 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 CTK4E2894?
The CAS number of CTK4E2894 is 1997-60-0.
What is the molecular formula of CTK4E2894?
The molecular formula of CTK4E2894 is C24H25FN4O3.
What is the molecular weight of CTK4E2894?
The molecular weight of CTK4E2894 is 436.19 g/mol.
Where can I buy CTK4E2894?
You can request a quote for CTK4E2894 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK4E2894?
Yes, KEHONG BIO provides custom synthesis services for CTK4E2894 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.