CTK8H4626
TL;DR: CTK8H4626 (CAS 19665-39-5) is a chemical compound with molecular formula C18H18O9 and molecular weight 378.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 7-(1,4-dimethoxy-1,4-dioxobut-2-en-2-yl)-6,7-dihydro-1-benzofuran-4,5-dicarboxylate
| Molecular Formula | C18H18O9 |
|---|---|
| Molecular Weight | 378.10 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 378.0951 |
| Heavy Atoms | 27 |
| Complexity | 704.0 |
Chemical Identifiers
| CAS Number | 19665-39-5 |
|---|---|
| SMILES | COC(=O)C=C(C1CC(=C(C2=C1OC=C2)C(=O)OC)C(=O)OC)C(=O)OC |
| InChIKey | SAIBDAXMBYNLHQ-UHFFFAOYSA-N |
Product Overview
CTK8H4626 (CAS 19665-39-5), with molecular formula C18H18O9 and molecular weight 378.10 g/mol. IUPAC: dimethyl 7-(1,4-dimethoxy-1,4-dioxobut-2-en-2-yl)-6,7-dihydro-1-benzofuran-4,5-dicarboxylate.
Chemical Property Profile of CTK8H4626
Property Insights of CTK8H4626
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK8H4626. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK8H4626. Following Lipinski's Rule of Five, CTK8H4626 has 0 hydrogen bond donor(s) and 9 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 CTK8H4626?
The CAS number of CTK8H4626 is 19665-39-5.
What is the molecular formula of CTK8H4626?
The molecular formula of CTK8H4626 is C18H18O9.
What is the molecular weight of CTK8H4626?
The molecular weight of CTK8H4626 is 378.10 g/mol.
Where can I buy CTK8H4626?
You can request a quote for CTK8H4626 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK8H4626?
Yes, KEHONG BIO provides custom synthesis services for CTK8H4626 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.