CTK4G8054
TL;DR: CTK4G8054 (CAS 3200-07-5) is a chemical compound with molecular formula C28H37NO7 and molecular weight 499.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoyl]oxyethyl]azanium;4-hydroxy-4-oxobut-2-enoate
Also Known As: DIETHYL-[2-[2-(NAPHTHALEN-1-YLMETHYL)-3-(OXOLAN-2-YL)PROPANOYL]OXYETHYL]AZANIUM; 4-HYDROXY-4-OXO-BUT-2-ENOATE
| Molecular Formula | C28H37NO7 |
|---|---|
| Molecular Weight | 499.26 g/mol |
| LogP | 1.41 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 499.257 |
| Heavy Atoms | 36 |
| Complexity | 594.0 |
Chemical Identifiers
| CAS Number | 3200-07-5 |
|---|---|
| SMILES | CC[NH+](CC)CCOC(=O)C(CC1CCCO1)CC2=CC=CC3=CC=CC=C32.C(=CC(=O)[O-])C(=O)O |
| InChIKey | UIBJEGDYQIIWSS-UHFFFAOYSA-N |
Product Overview
CTK4G8054 (CAS 3200-07-5), with molecular formula C28H37NO7 and molecular weight 499.26 g/mol. IUPAC: diethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoyl]oxyethyl]azanium;4-hydroxy-4-oxobut-2-enoate.
Chemical Property Profile of CTK4G8054
Property Insights of CTK4G8054
The XLogP value of 1.41 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK4G8054. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK4G8054. Following Lipinski's Rule of Five, CTK4G8054 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 CTK4G8054?
The CAS number of CTK4G8054 is 3200-07-5.
What is the molecular formula of CTK4G8054?
The molecular formula of CTK4G8054 is C28H37NO7.
What is the molecular weight of CTK4G8054?
The molecular weight of CTK4G8054 is 499.26 g/mol.
Where can I buy CTK4G8054?
You can request a quote for CTK4G8054 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK4G8054?
Yes, KEHONG BIO provides custom synthesis services for CTK4G8054 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.