3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one
TL;DR: 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one (CAS 525581-53-7) is a chemical compound with molecular formula C18H18N2O3S and molecular weight 342.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one
Also Known As: 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one, 3-(2,3-dimethylphenyl)-2-mercapto-6,7-dimethoxyquinazolin-4(3H)-one, 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanyl-3-hydroquinazolin-4-one, 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one, 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
| Molecular Formula | C18H18N2O3S |
|---|---|
| Molecular Weight | 342.10 g/mol |
| LogP | 3.68233 |
| Topological Polar Surface Area | 56.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 342.10382 |
| Heavy Atoms | 24 |
| Complexity | 1050.5388 |
Chemical Identifiers
| CAS Number | 525581-53-7 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)N2C(=O)C3=CC(=C(C=C3NC2=S)OC)OC)C |
Product Overview
3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one (CAS 525581-53-7), with molecular formula C18H18N2O3S and molecular weight 342.10 g/mol. IUPAC: 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one.
Chemical Property Profile of 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one
Property Insights of 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one
The XLogP value of 3.68233 indicates that 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.25 Ų, 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one has 1 hydrogen bond donor(s) and 4 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 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one?
The CAS number of 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one is 525581-53-7.
What is the molecular formula of 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one?
The molecular formula of 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one is C18H18N2O3S.
What is the molecular weight of 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one?
The molecular weight of 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one is 342.10 g/mol.
Where can I buy 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one?
You can request a quote for 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,3-dimethylphenyl)-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.