3-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-one
TL;DR: 3-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-one (CAS 719281-69-3) is a chemical compound with molecular formula C22H18N2O2S and molecular weight 374.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-3-phenylmethoxyquinazolin-4-one
Also Known As: TimTec1_002653, 2-benzylsulfanyl-3-phenylmethoxyquinazolin-4-one, 3-(benzyloxy)-2-(benzylthio)quinazolin-4(3H)-one, 3-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-one, 3-(phenylmethoxy)-2-(phenylmethylthio)-3-hydroquinazolin-4-one
| Molecular Formula | C22H18N2O2S |
|---|---|
| Molecular Weight | 374.11 g/mol |
| LogP | 4.3176 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 374.1089 |
| Heavy Atoms | 27 |
| Complexity | 1095.5267 |
Chemical Identifiers
| CAS Number | 719281-69-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CON2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=C4 |
Product Overview
3-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-one (CAS 719281-69-3), with molecular formula C22H18N2O2S and molecular weight 374.11 g/mol. IUPAC: 2-benzylsulfanyl-3-phenylmethoxyquinazolin-4-one.
Chemical Property Profile of 3-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-one
Property Insights of 3-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-one
The XLogP value of 4.3176 indicates that 3-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-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-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-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-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-one?
The CAS number of 3-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-one is 719281-69-3.
What is the molecular formula of 3-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-one?
The molecular formula of 3-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-one is C22H18N2O2S.
What is the molecular weight of 3-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-one?
The molecular weight of 3-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-one is 374.11 g/mol.
Where can I buy 3-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-one?
You can request a quote for 3-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(benzyloxy)-2-(benzylsulfanyl)quinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.