Ethanone, 1-(4-chlorophenyl)-2-(4-quinazolinylthio)-
TL;DR: Ethanone, 1-(4-chlorophenyl)-2-(4-quinazolinylthio)- (CAS 31737-20-9) is a chemical compound with molecular formula C16H11ClN2OS and molecular weight 314.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-2-quinazolin-4-ylsulfanylethanone
Also Known As: 1-methyl-6-chlorouracil, 1-(4-Chlorophenyl)-2-(quinazolin-4-ylthio)ethanone, Ethanone, 1-(4-chlorophenyl)-2-(4-quinazolinylthio)-, 1-(4-chlorophenyl)-2-quinazolin-4-ylsulfanylethanone, 1-(4-chlorophenyl)-2-(quinazolin-4-ylsulfanyl)ethan-1-one
| Molecular Formula | C16H11ClN2OS |
|---|---|
| Molecular Weight | 314.03 g/mol |
| LogP | 4.2582 |
| Topological Polar Surface Area | 42.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 314.02808 |
| Heavy Atoms | 21 |
| Complexity | 784.3938 |
Chemical Identifiers
| CAS Number | 31737-20-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)C3=CC=C(C=C3)Cl |
Product Overview
Ethanone, 1-(4-chlorophenyl)-2-(4-quinazolinylthio)- (CAS 31737-20-9), with molecular formula C16H11ClN2OS and molecular weight 314.03 g/mol. IUPAC: 1-(4-chlorophenyl)-2-quinazolin-4-ylsulfanylethanone.
Chemical Property Profile of Ethanone, 1-(4-chlorophenyl)-2-(4-quinazolinylthio)-
Property Insights of Ethanone, 1-(4-chlorophenyl)-2-(4-quinazolinylthio)-
The XLogP value of 4.2582 indicates that Ethanone, 1-(4-chlorophenyl)-2-(4-quinazolinylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.85 Ų, Ethanone, 1-(4-chlorophenyl)-2-(4-quinazolinylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-(4-chlorophenyl)-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-(4-chlorophenyl)-2-(4-quinazolinylthio)-?
The CAS number of Ethanone, 1-(4-chlorophenyl)-2-(4-quinazolinylthio)- is 31737-20-9.
What is the molecular formula of Ethanone, 1-(4-chlorophenyl)-2-(4-quinazolinylthio)-?
The molecular formula of Ethanone, 1-(4-chlorophenyl)-2-(4-quinazolinylthio)- is C16H11ClN2OS.
What is the molecular weight of Ethanone, 1-(4-chlorophenyl)-2-(4-quinazolinylthio)-?
The molecular weight of Ethanone, 1-(4-chlorophenyl)-2-(4-quinazolinylthio)- is 314.03 g/mol.
Where can I buy Ethanone, 1-(4-chlorophenyl)-2-(4-quinazolinylthio)-?
You can request a quote for Ethanone, 1-(4-chlorophenyl)-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-(4-chlorophenyl)-2-(4-quinazolinylthio)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(4-chlorophenyl)-2-(4-quinazolinylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.