Ethanone, 1-phenyl-2-(4-quinazolinylthio)-
TL;DR: Ethanone, 1-phenyl-2-(4-quinazolinylthio)- (CAS 31737-18-5) is a chemical compound with molecular formula C16H12N2OS and molecular weight 280.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-2-quinazolin-4-ylsulfanylethanone
Also Known As: 1-Phenyl-2-(quinazolin-4-ylthio)ethanone, 1-phenyl-2-quinazolin-4-ylsulfanylethanone, Ethanone, 1-phenyl-2-(4-quinazolinylthio)-, SDCCGSBI-0660576.P001, 1-phenyl-2-quinazolin-4-ylthioethan-1-one
| Molecular Formula | C16H12N2OS |
|---|---|
| Molecular Weight | 280.07 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 68.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.06705 |
| Heavy Atoms | 20 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 31737-18-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CSC2=NC=NC3=CC=CC=C32 |
| InChIKey | OJEPUPXYQONQNE-UHFFFAOYSA-N |
Product Overview
Ethanone, 1-phenyl-2-(4-quinazolinylthio)- (CAS 31737-18-5), with molecular formula C16H12N2OS and molecular weight 280.07 g/mol. IUPAC: 1-phenyl-2-quinazolin-4-ylsulfanylethanone.
Chemical Property Profile of Ethanone, 1-phenyl-2-(4-quinazolinylthio)-
Property Insights of Ethanone, 1-phenyl-2-(4-quinazolinylthio)-
The XLogP value of 3.8 indicates that Ethanone, 1-phenyl-2-(4-quinazolinylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanone, 1-phenyl-2-(4-quinazolinylthio)-. Following Lipinski's Rule of Five, Ethanone, 1-phenyl-2-(4-quinazolinylthio)- 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 Ethanone, 1-phenyl-2-(4-quinazolinylthio)-?
The CAS number of Ethanone, 1-phenyl-2-(4-quinazolinylthio)- is 31737-18-5.
What is the molecular formula of Ethanone, 1-phenyl-2-(4-quinazolinylthio)-?
The molecular formula of Ethanone, 1-phenyl-2-(4-quinazolinylthio)- is C16H12N2OS.
What is the molecular weight of Ethanone, 1-phenyl-2-(4-quinazolinylthio)-?
The molecular weight of Ethanone, 1-phenyl-2-(4-quinazolinylthio)- is 280.07 g/mol.
Where can I buy Ethanone, 1-phenyl-2-(4-quinazolinylthio)-?
You can request a quote for Ethanone, 1-phenyl-2-(4-quinazolinylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-phenyl-2-(4-quinazolinylthio)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-phenyl-2-(4-quinazolinylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.