![2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one structure](/static/products/499/499125-01-8.png)
2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one
TL;DR: 2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one (CAS 499125-01-8) is a chemical compound with molecular formula C25H20N2O5S and molecular weight 460.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one
Also Known As: 2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one, 2-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one, 2-{[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl}-3-(4-ethoxyphenyl)quinazolin-4(3H)-one, 2-((2-(benzo[d][1,3]dioxol-5-yl)-2-oxoethyl)thio)-3-(4-ethoxyphenyl)quinazolin-4(3H)-one, 2-(2-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-2-oxoethylthio)-3-(4-ethoxyphenyl)-3-h ydroquinazolin-4-one
| Molecular Formula | C25H20N2O5S |
|---|---|
| Molecular Weight | 460.11 g/mol |
| LogP | 4.4881 |
| Topological Polar Surface Area | 79.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 460.10928 |
| Heavy Atoms | 33 |
| Complexity | 1398.5844 |
Chemical Identifiers
| CAS Number | 499125-01-8 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC5=C(C=C4)OCO5 |
Product Overview
2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one (CAS 499125-01-8), with molecular formula C25H20N2O5S and molecular weight 460.11 g/mol. IUPAC: 2-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one.
Chemical Property Profile of 2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one
Property Insights of 2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one
The XLogP value of 4.4881 indicates that 2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one. Following Lipinski's Rule of Five, 2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one has 0 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 2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one?
The CAS number of 2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one is 499125-01-8.
What is the molecular formula of 2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one?
The molecular formula of 2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one is C25H20N2O5S.
What is the molecular weight of 2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one?
The molecular weight of 2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one is 460.11 g/mol.
Where can I buy 2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one?
You can request a quote for 2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-benzo[1,3]dioxol-5-yl-2-oxo-ethyl)sulfanyl-3-(4-ethoxyphenyl)quinazolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.