2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide
TL;DR: 2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide (CAS 709006-01-9) is a chemical compound with molecular formula C20H16N4O3S2 and molecular weight 424.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanyl-N-(4-oxo-1,3-benzothiazin-2-yl)acetamide
Also Known As: 2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide, 2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanyl-N-(4-oxo-1,3-benzothiazin-2-yl)acetamide, 2-((3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N-(4-oxo-4H-benzo[e][1,3]thiazin-2-yl)acetamide, 2-(3-ethyl-4-oxo(3-hydroquinazolin-2-ylthio))-N-(4-oxobenzo[e]1,3-thiazin-2-yl )acetamide, 2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-[(2E)-4-hydroxy-2H-1,3-benzothiazin-2-ylidene]acetamide
| Molecular Formula | C20H16N4O3S2 |
|---|---|
| Molecular Weight | 424.07 g/mol |
| LogP | 3.1171 |
| Topological Polar Surface Area | 93.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 424.06638 |
| Heavy Atoms | 29 |
| Complexity | 1347.1365 |
Chemical Identifiers
| CAS Number | 709006-01-9 |
|---|---|
| SMILES | CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=NC(=O)C4=CC=CC=C4S3 |
Product Overview
2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide (CAS 709006-01-9), with molecular formula C20H16N4O3S2 and molecular weight 424.07 g/mol. IUPAC: 2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanyl-N-(4-oxo-1,3-benzothiazin-2-yl)acetamide.
Chemical Property Profile of 2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide
Property Insights of 2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide
The XLogP value of 3.1171 indicates that 2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.95 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide. Following Lipinski's Rule of Five, 2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide has 1 hydrogen bond donor(s) and 7 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-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide?
The CAS number of 2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide is 709006-01-9.
What is the molecular formula of 2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide?
The molecular formula of 2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide is C20H16N4O3S2.
What is the molecular weight of 2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide?
The molecular weight of 2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide is 424.07 g/mol.
Where can I buy 2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide?
You can request a quote for 2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-ethyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4-oxo-4H-1,3-benzothiazin-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.