![5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid structure](/static/products/879/879052-25-2.png)
5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid
TL;DR: 5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid (CAS 879052-25-2) is a chemical compound with molecular formula C14H11NO4S and molecular weight 289.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3-oxo-1,4-benzothiazin-4-yl)methyl]furan-2-carboxylic acid
Also Known As: ASN 14722493, 5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid, 5-[(3-oxo-1,4-benzothiazin-4-yl)methyl]furan-2-carboxylic acid, 5-(3-Oxo-2,3-dihydro-benzo[1,4]thiazin-4-ylmethyl)-furan-2-carboxylic acid, 5-[(3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl)methyl]furan-2-carboxylic acid
| Molecular Formula | C14H11NO4S |
|---|---|
| Molecular Weight | 289.04 g/mol |
| LogP | 2.6167 |
| Topological Polar Surface Area | 70.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.0409 |
| Heavy Atoms | 20 |
| Complexity | 679.31836 |
Chemical Identifiers
| CAS Number | 879052-25-2 |
|---|---|
| SMILES | C1C(=O)N(C2=CC=CC=C2S1)CC3=CC=C(O3)C(=O)O |
Product Overview
5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid (CAS 879052-25-2), with molecular formula C14H11NO4S and molecular weight 289.04 g/mol. IUPAC: 5-[(3-oxo-1,4-benzothiazin-4-yl)methyl]furan-2-carboxylic acid.
Chemical Property Profile of 5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid
Property Insights of 5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid
The XLogP value of 2.6167 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid. The TPSA of 70.75 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid. Following Lipinski's Rule of Five, 5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid 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 5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid?
The CAS number of 5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid is 879052-25-2.
What is the molecular formula of 5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid?
The molecular formula of 5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid is C14H11NO4S.
What is the molecular weight of 5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid?
The molecular weight of 5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid is 289.04 g/mol.
Where can I buy 5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid?
You can request a quote for 5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-((3-oxo-2H-benzo[b][1,4]thiazin-4(3H)-yl)methyl)furan-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.