3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one
TL;DR: 3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one (CAS 1042-80-4) is a chemical compound with molecular formula C18H16N2O2S and molecular weight 324.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one
Also Known As: BAS 02141187, BIM-0017803.P001, 2-(allylthio)-3-(2-methoxyphenyl)quinazolin-4(3H)-one, 3-(2-methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one, 2-Allylsulfanyl-3-(2-methoxy-phenyl)-3H-quinazolin-4-one
| Molecular Formula | C18H16N2O2S |
|---|---|
| Molecular Weight | 324.09 g/mol |
| LogP | 3.6724 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 324.09326 |
| Heavy Atoms | 23 |
| Complexity | 918.2838 |
Chemical Identifiers
| CAS Number | 1042-80-4 |
|---|---|
| SMILES | COC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC=C |
Product Overview
3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one (CAS 1042-80-4), with molecular formula C18H16N2O2S and molecular weight 324.09 g/mol. IUPAC: 3-(2-methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one.
Chemical Property Profile of 3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one
Property Insights of 3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one
The XLogP value of 3.6724 indicates that 3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.12 Ų, 3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one has 0 hydrogen bond donor(s) and 4 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 3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one?
The CAS number of 3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one is 1042-80-4.
What is the molecular formula of 3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one?
The molecular formula of 3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one is C18H16N2O2S.
What is the molecular weight of 3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one?
The molecular weight of 3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one is 324.09 g/mol.
Where can I buy 3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one?
You can request a quote for 3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Methoxyphenyl)-2-prop-2-enylsulfanylquinazolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.