4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide
TL;DR: 4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide (CAS 352659-18-8) is a chemical compound with molecular formula C16H13ClN2S and molecular weight 300.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methylsulfanyl]-4-methylquinazoline
Also Known As: 4-chlorobenzyl 4-methyl-2-quinazolinyl sulfide, 2-[(4-chlorophenyl)methylsulfanyl]-4-methylquinazoline, 2-((4-chlorobenzyl)thio)-4-methylquinazoline, 2-[(4-chlorobenzyl)sulfanyl]-4-methylquinazoline, AJ-292/14596005
| Molecular Formula | C16H13ClN2S |
|---|---|
| Molecular Weight | 300.05 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 51.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 300.0488 |
| Heavy Atoms | 20 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 352659-18-8 |
|---|---|
| SMILES | CC1=NC(=NC2=CC=CC=C12)SCC3=CC=C(C=C3)Cl |
| InChIKey | JSHBWRNKYXHTMV-UHFFFAOYSA-N |
Product Overview
4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide (CAS 352659-18-8), with molecular formula C16H13ClN2S and molecular weight 300.05 g/mol. IUPAC: 2-[(4-chlorophenyl)methylsulfanyl]-4-methylquinazoline.
Chemical Property Profile of 4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide
Property Insights of 4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide
The XLogP value of 4.9 indicates that 4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.1 Ų, 4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide 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 4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide?
The CAS number of 4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide is 352659-18-8.
What is the molecular formula of 4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide?
The molecular formula of 4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide is C16H13ClN2S.
What is the molecular weight of 4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide?
The molecular weight of 4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide is 300.05 g/mol.
Where can I buy 4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide?
You can request a quote for 4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide?
Yes, KEHONG BIO provides custom synthesis services for 4-Chlorobenzyl 4-methyl-2-quinazolinyl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.