![4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide structure](/static/products/725/725690-73-3.png)
4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide
TL;DR: 4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide (CAS 725690-73-3) is a chemical compound with molecular formula C17H17N3O5S2 and molecular weight 407.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(6,7-dimethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]benzenesulfonamide
Also Known As: 4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide, 4-[(6,7-dimethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]benzenesulfonamide, 4-((6,7-dimethoxy-4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)benzenesulfonamide, 4-[(6,7-dimethoxy-4-oxo-2-sulfanylquinazolin-3(4H)-yl)methyl]benzenesulfonamide, 4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,3-dihydroquinazolin-3-yl)methyl]benzenesulf onamide
| Molecular Formula | C17H17N3O5S2 |
|---|---|
| Molecular Weight | 407.06 g/mol |
| LogP | 1.77199 |
| Topological Polar Surface Area | 116.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 407.06097 |
| Heavy Atoms | 27 |
| Complexity | 1228.389 |
Chemical Identifiers
| CAS Number | 725690-73-3 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CC3=CC=C(C=C3)S(=O)(=O)N)OC |
Product Overview
4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide (CAS 725690-73-3), with molecular formula C17H17N3O5S2 and molecular weight 407.06 g/mol. IUPAC: 4-[(6,7-dimethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]benzenesulfonamide.
Chemical Property Profile of 4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide
Property Insights of 4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide
The XLogP value of 1.77199 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide. The TPSA of 116.41 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide. Following Lipinski's Rule of Five, 4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide has 2 hydrogen bond donor(s) and 6 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-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide?
The CAS number of 4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide is 725690-73-3.
What is the molecular formula of 4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide?
The molecular formula of 4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide is C17H17N3O5S2.
What is the molecular weight of 4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide?
The molecular weight of 4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide is 407.06 g/mol.
Where can I buy 4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide?
You can request a quote for 4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.