7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one
TL;DR: 7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one (CAS 118449-37-9) is a chemical compound with molecular formula C14H8Cl2N2OS and molecular weight 321.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-3-(4-chlorophenyl)-2-sulfanylidene-1H-quinazolin-4-one
Also Known As: 7-chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one, J2.744.228E, 7-chloro-3-(4-chlorophenyl)-2-mercaptoquinazolin-4(3H)-one, AB00981391-01, 7-chloro-3-(4-chlorophenyl)-2-sulfanylidene-1H-quinazolin-4-one
| Molecular Formula | C14H8Cl2N2OS |
|---|---|
| Molecular Weight | 321.97 g/mol |
| LogP | 4.35509 |
| Topological Polar Surface Area | 37.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 321.97345 |
| Heavy Atoms | 20 |
| Complexity | 913.0906 |
Chemical Identifiers
| CAS Number | 118449-37-9 |
|---|---|
| SMILES | C1=CC(=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)NC2=S)Cl |
Product Overview
7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one (CAS 118449-37-9), with molecular formula C14H8Cl2N2OS and molecular weight 321.97 g/mol. IUPAC: 7-chloro-3-(4-chlorophenyl)-2-sulfanylidene-1H-quinazolin-4-one.
Chemical Property Profile of 7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one
Property Insights of 7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one
The XLogP value of 4.35509 indicates that 7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.79 Ų, 7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one has 1 hydrogen bond donor(s) and 2 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 7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one?
The CAS number of 7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one is 118449-37-9.
What is the molecular formula of 7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one?
The molecular formula of 7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one is C14H8Cl2N2OS.
What is the molecular weight of 7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one?
The molecular weight of 7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one is 321.97 g/mol.
Where can I buy 7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one?
You can request a quote for 7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 7-Chloro-3-(4-chlorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.