![2-[(3-Chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline structure](/static/products/5870/587002-34-4.webp)
2-[(3-Chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline
TL;DR: 2-[(3-Chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline (CAS 587002-34-4) is a chemical compound with molecular formula C16H17ClN2S and molecular weight 304.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-chlorophenyl)methylsulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline
Also Known As: 2-[(3-chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline, 2-((3-chlorobenzyl)thio)-4-methyl-5,6,7,8-tetrahydroquinazoline, 2-[(3-chlorophenyl)methylsulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline, 2-[(3-chlorophenyl)methylthio]-4-methyl-5,6,7,8-tetrahydroquinazoline, 2-{[(3-CHLOROPHENYL)METHYL]SULFANYL}-4-METHYL-5,6,7,8-TETRAHYDROQUINAZOLINE
| Molecular Formula | C16H17ClN2S |
|---|---|
| Molecular Weight | 304.08 g/mol |
| LogP | 4.60952 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 304.0801 |
| Heavy Atoms | 20 |
| Complexity | 627.8691 |
Chemical Identifiers
| CAS Number | 587002-34-4 |
|---|---|
| SMILES | CC1=C2CCCCC2=NC(=N1)SCC3=CC(=CC=C3)Cl |
Product Overview
2-[(3-Chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline (CAS 587002-34-4), with molecular formula C16H17ClN2S and molecular weight 304.08 g/mol. IUPAC: 2-[(3-chlorophenyl)methylsulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline.
Chemical Property Profile of 2-[(3-Chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline
Property Insights of 2-[(3-Chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline
The XLogP value of 4.60952 indicates that 2-[(3-Chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline 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-methyl-5,6,7,8-tetrahydroquinazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(3-Chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline 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 2-[(3-Chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline?
The CAS number of 2-[(3-Chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline is 587002-34-4.
What is the molecular formula of 2-[(3-Chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline?
The molecular formula of 2-[(3-Chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline is C16H17ClN2S.
What is the molecular weight of 2-[(3-Chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline?
The molecular weight of 2-[(3-Chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline is 304.08 g/mol.
Where can I buy 2-[(3-Chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline?
You can request a quote for 2-[(3-Chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline 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-methyl-5,6,7,8-tetrahydroquinazoline?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-Chlorobenzyl)sulfanyl]-4-methyl-5,6,7,8-tetrahydroquinazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.