![2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one structure](/static/products/587/587003-37-0.png)
2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one
TL;DR: 2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one (CAS 587003-37-0) is a chemical compound with molecular formula C16H13ClN2O2S and molecular weight 332.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one
Also Known As: 2-[(3-chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one, 2-(3-Chloro-benzylsulfanyl)-3-methoxy-3H-quinazolin-4-one, 2-[(3-chlorobenzyl)thio]-3-methoxy-quinazolin-4-one, 2-((3-chlorobenzyl)thio)-3-methoxyquinazolin-4(3H)-one, 2-[(3-chlorophenyl)methylthio]-3-methoxy-4-quinazolinone
| Molecular Formula | C16H13ClN2O2S |
|---|---|
| Molecular Weight | 332.04 g/mol |
| LogP | 3.4006 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 332.03864 |
| Heavy Atoms | 22 |
| Complexity | 879.394 |
Chemical Identifiers
| CAS Number | 587003-37-0 |
|---|---|
| SMILES | CON1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=CC=C3)Cl |
Product Overview
2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one (CAS 587003-37-0), with molecular formula C16H13ClN2O2S and molecular weight 332.04 g/mol. IUPAC: 2-[(3-chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one.
Chemical Property Profile of 2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one
Property Insights of 2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one
The XLogP value of 3.4006 indicates that 2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-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, 2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-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 2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one?
The CAS number of 2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one is 587003-37-0.
What is the molecular formula of 2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one?
The molecular formula of 2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one is C16H13ClN2O2S.
What is the molecular weight of 2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one?
The molecular weight of 2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one is 332.04 g/mol.
Where can I buy 2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one?
You can request a quote for 2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-Chlorophenyl)methylsulfanyl]-3-methoxyquinazolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.