CTK5E5720
TL;DR: CTK5E5720 (CAS 78356-76-0) is a chemical compound with molecular formula C25H19N3O7 and molecular weight 473.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[2-[2-(4-hydroxy-3-methoxyphenyl)ethenyl]-7-nitro-4-oxoquinazolin-3-yl]benzoate
Also Known As: methyl 4-[(2Z)-2-[(2Z)-2-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)ethylidene]-7-nitro-4-oxo-1H-quinazolin-3-yl]benzoate
| Molecular Formula | C25H19N3O7 |
|---|---|
| Molecular Weight | 473.12 g/mol |
| LogP | 3.9651 |
| Topological Polar Surface Area | 133.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 473.1223 |
| Heavy Atoms | 35 |
| Complexity | 1539.7312 |
Chemical Identifiers
| CAS Number | 78356-76-0 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C=CC2=NC3=C(C=CC(=C3)[N+](=O)[O-])C(=O)N2C4=CC=C(C=C4)C(=O)OC)O |
Product Overview
CTK5E5720 (CAS 78356-76-0), with molecular formula C25H19N3O7 and molecular weight 473.12 g/mol. IUPAC: methyl 4-[2-[2-(4-hydroxy-3-methoxyphenyl)ethenyl]-7-nitro-4-oxoquinazolin-3-yl]benzoate.
Chemical Property Profile of CTK5E5720
Property Insights of CTK5E5720
The XLogP value of 3.9651 indicates that CTK5E5720 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 133.79 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK5E5720. Following Lipinski's Rule of Five, CTK5E5720 has 1 hydrogen bond donor(s) and 8 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 CTK5E5720?
The CAS number of CTK5E5720 is 78356-76-0.
What is the molecular formula of CTK5E5720?
The molecular formula of CTK5E5720 is C25H19N3O7.
What is the molecular weight of CTK5E5720?
The molecular weight of CTK5E5720 is 473.12 g/mol.
Where can I buy CTK5E5720?
You can request a quote for CTK5E5720 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK5E5720?
Yes, KEHONG BIO provides custom synthesis services for CTK5E5720 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.