2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone
TL;DR: 2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone (CAS 90852-43-0) is a chemical compound with molecular formula C17H16N2OS and molecular weight 296.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-3-ethylquinazolin-4-one
Also Known As: 2-benzylsulfanyl-3-ethylquinazolin-4-one, 2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone, BAS 00718699, 2-(benzylsulfanyl)-3-ethylquinazolin-4(3H)-one, 2-(benzylthio)-3-ethylquinazolin-4(3H)-one
| Molecular Formula | C17H16N2OS |
|---|---|
| Molecular Weight | 296.10 g/mol |
| LogP | 3.7087 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.09833 |
| Heavy Atoms | 21 |
| Complexity | 811.8831 |
Chemical Identifiers
| CAS Number | 90852-43-0 |
|---|---|
| SMILES | CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=CC=C3 |
Product Overview
2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone (CAS 90852-43-0), with molecular formula C17H16N2OS and molecular weight 296.10 g/mol. IUPAC: 2-benzylsulfanyl-3-ethylquinazolin-4-one.
Chemical Property Profile of 2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone
Property Insights of 2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone
The XLogP value of 3.7087 indicates that 2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone has 0 hydrogen bond donor(s) and 3 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-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone?
The CAS number of 2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone is 90852-43-0.
What is the molecular formula of 2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone?
The molecular formula of 2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone is C17H16N2OS.
What is the molecular weight of 2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone?
The molecular weight of 2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone is 296.10 g/mol.
Where can I buy 2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone?
You can request a quote for 2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone?
Yes, KEHONG BIO provides custom synthesis services for 2-(benzylsulfanyl)-3-ethyl-4(3H)-quinazolinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.