N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide
TL;DR: N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide (CAS 725690-90-4) is a chemical compound with molecular formula C15H13N3O4S2 and molecular weight 363.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6,7-dimethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)thiophene-2-carboxamide
Also Known As: N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide, N-(6,7-dimethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)thiophene-2-carboxamide, N-(6,7-dimethoxy-4-oxo-2-sulfanylquinazolin-3(4H)-yl)thiophene-2-carboxamide, N-(6,7-dimethoxy-4-oxo-2-thioxo(1,3-dihydroquinazolin-3-yl))-2-thienylcarboxam ide, N-(6,7-dimethoxy-4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)thiophene-2-carboxamide
| Molecular Formula | C15H13N3O4S2 |
|---|---|
| Molecular Weight | 363.03 g/mol |
| LogP | 2.52169 |
| Topological Polar Surface Area | 85.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 363.03476 |
| Heavy Atoms | 24 |
| Complexity | 1021.6106 |
Chemical Identifiers
| CAS Number | 725690-90-4 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)NC(=O)C3=CC=CS3)OC |
Product Overview
N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide (CAS 725690-90-4), with molecular formula C15H13N3O4S2 and molecular weight 363.03 g/mol. IUPAC: N-(6,7-dimethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)thiophene-2-carboxamide.
Chemical Property Profile of N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide
Property Insights of N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide
The XLogP value of 2.52169 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide. The TPSA of 85.35 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide. Following Lipinski's Rule of Five, N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide 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 N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide?
The CAS number of N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide is 725690-90-4.
What is the molecular formula of N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide?
The molecular formula of N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide is C15H13N3O4S2.
What is the molecular weight of N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide?
The molecular weight of N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide is 363.03 g/mol.
Where can I buy N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide?
You can request a quote for N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6,7-dimethoxy-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)thiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.