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Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate
TL;DR: Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate (CAS 488804-49-5) is a chemical compound with molecular formula C19H17IN2O4S and molecular weight 496.00 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]sulfanylacetate
Also Known As: CBKinase1_005450, CBKinase1_017850, BRD-K07238298-001-01-3, ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate, Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanylacetate
| Molecular Formula | C19H17IN2O4S |
|---|---|
| Molecular Weight | 496.00 g/mol |
| LogP | 3.6541 |
| Topological Polar Surface Area | 70.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 495.9954 |
| Heavy Atoms | 27 |
| Complexity | 1051.5493 |
Chemical Identifiers
| CAS Number | 488804-49-5 |
|---|---|
| SMILES | CCOC(=O)CSC1=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]sulfanylacetate (CAS 488804-49-5), with molecular formula C19H17IN2O4S and molecular weight 496.00 g/mol. IUPAC: ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate.
Chemical Property Profile of Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate
Property Insights of Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate
The XLogP value of 3.6541 indicates that Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate 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]sulfanylacetate. Following Lipinski's Rule of Five, Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate has 0 hydrogen bond donor(s) and 6 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 Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate?
The CAS number of Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate is 488804-49-5.
What is the molecular formula of Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate?
The molecular formula of Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate is C19H17IN2O4S.
What is the molecular weight of Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate?
The molecular weight of Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate is 496.00 g/mol.
Where can I buy Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate?
You can request a quote for Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate 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]sulfanylacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[6-iodo-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.