1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione
TL;DR: 1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione (CAS 831240-85-8) is a chemical compound with molecular formula C22H22N2S and molecular weight 346.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione
Also Known As: 1-benzyl-2-(3-methylphenyl)-1,4,5,6,7,8-hexahydroquinazoline-4-thione, F1738-0021, 1-benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione, 1-benzyl-2-(m-tolyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione, 2-(3-methylphenyl)-1-benzyl-1,5,6,7,8-pentahydroquinazoline-4-thione
| Molecular Formula | C22H22N2S |
|---|---|
| Molecular Weight | 346.15 g/mol |
| LogP | 5.51511 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 346.15036 |
| Heavy Atoms | 25 |
| Complexity | 957.5064 |
Chemical Identifiers
| CAS Number | 831240-85-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2=NC(=S)C3=C(N2CC4=CC=CC=C4)CCCC3 |
Product Overview
1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione (CAS 831240-85-8), with molecular formula C22H22N2S and molecular weight 346.15 g/mol. IUPAC: 1-benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione.
Chemical Property Profile of 1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione
Property Insights of 1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione
The XLogP value of 5.51511 indicates that 1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.82 Ų, 1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione?
The CAS number of 1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione is 831240-85-8.
What is the molecular formula of 1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione?
The molecular formula of 1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione is C22H22N2S.
What is the molecular weight of 1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione?
The molecular weight of 1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione is 346.15 g/mol.
Where can I buy 1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione?
You can request a quote for 1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazoline-4-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.