![Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate structure](/static/products/6944/694457-22-2.webp)
Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate
TL;DR: Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate (CAS 694457-22-2) is a chemical compound with molecular formula C20H19IN2O4S and molecular weight 510.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate
Also Known As: CBKinase1_003545, CBKinase1_015945, BRD-A00830138-001-01-0, ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate, ethyl 2-((6-iodo-3-(2-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)propanoate
| Molecular Formula | C20H19IN2O4S |
|---|---|
| Molecular Weight | 510.01 g/mol |
| LogP | 4.0426 |
| Topological Polar Surface Area | 70.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 510.01102 |
| Heavy Atoms | 28 |
| Complexity | 1083.479 |
Chemical Identifiers
| CAS Number | 694457-22-2 |
|---|---|
| SMILES | CCOC(=O)C(C)SC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC=CC=C3OC |
Product Overview
Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate (CAS 694457-22-2), with molecular formula C20H19IN2O4S and molecular weight 510.01 g/mol. IUPAC: ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate.
Chemical Property Profile of Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate
Property Insights of Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate
The XLogP value of 4.0426 indicates that Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.42 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate. Following Lipinski's Rule of Five, Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate?
The CAS number of Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate is 694457-22-2.
What is the molecular formula of Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate?
The molecular formula of Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate is C20H19IN2O4S.
What is the molecular weight of Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate?
The molecular weight of Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate is 510.01 g/mol.
Where can I buy Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate?
You can request a quote for Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.