![2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline structure](/static/products/4992/499212-13-4.webp)
2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline
TL;DR: 2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline (CAS 499212-13-4) is a chemical compound with molecular formula C18H17ClN2S and molecular weight 328.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-chlorophenyl)methylsulfanyl]-4,6,7-trimethylquinazoline
Also Known As: 2-[(3-chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline, 2-((3-chlorobenzyl)thio)-4,6,7-trimethylquinazoline, 2-[(3-chlorophenyl)methylsulfanyl]-4,6,7-trimethylquinazoline, 2-[(3-chlorophenyl)methylthio]-4,6,7-trimethylquinazoline, 2-{[(3-CHLOROPHENYL)METHYL]SULFANYL}-4,6,7-TRIMETHYLQUINAZOLINE
| Molecular Formula | C18H17ClN2S |
|---|---|
| Molecular Weight | 328.08 g/mol |
| LogP | 5.50076 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.0801 |
| Heavy Atoms | 22 |
| Complexity | 845.85504 |
Chemical Identifiers
| CAS Number | 499212-13-4 |
|---|---|
| SMILES | CC1=CC2=C(N=C(N=C2C=C1C)SCC3=CC(=CC=C3)Cl)C |
Product Overview
2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline (CAS 499212-13-4), with molecular formula C18H17ClN2S and molecular weight 328.08 g/mol. IUPAC: 2-[(3-chlorophenyl)methylsulfanyl]-4,6,7-trimethylquinazoline.
Chemical Property Profile of 2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline
Property Insights of 2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline
The XLogP value of 5.50076 indicates that 2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.78 Ų, 2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline?
The CAS number of 2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline is 499212-13-4.
What is the molecular formula of 2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline?
The molecular formula of 2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline is C18H17ClN2S.
What is the molecular weight of 2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline?
The molecular weight of 2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline is 328.08 g/mol.
Where can I buy 2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline?
You can request a quote for 2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-Chlorobenzyl)sulfanyl]-4,6,7-trimethylquinazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.