![3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid structure](/static/products/3122/312290-27-0.webp)
3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid
TL;DR: 3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid (CAS 312290-27-0) is a chemical compound with molecular formula C15H10N2O4S and molecular weight 314.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-[(E)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]furan-2-yl]benzoic acid
Also Known As: BAS 00285598, BIM-0019900.P001, 3-[5-(2-Imino-4-oxo-thiazolidin-5-ylidenemethyl)-furan-2-yl]-benzoic acid, (E)-3-(5-((2-imino-4-oxothiazolidin-5-ylidene)methyl)furan-2-yl)benzoic acid, 3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid
| Molecular Formula | C15H10N2O4S |
|---|---|
| Molecular Weight | 314.04 g/mol |
| LogP | 2.5738 |
| Topological Polar Surface Area | 105.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 314.03613 |
| Heavy Atoms | 22 |
| Complexity | 835.57294 |
Chemical Identifiers
| CAS Number | 312290-27-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(=O)O)C2=CC=C(O2)/C=C/3\C(=O)N=C(S3)N |
Product Overview
3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid (CAS 312290-27-0), with molecular formula C15H10N2O4S and molecular weight 314.04 g/mol. IUPAC: 3-[5-[(E)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]furan-2-yl]benzoic acid.
Chemical Property Profile of 3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid
Property Insights of 3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid
The XLogP value of 2.5738 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid. The TPSA of 105.89 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid. Following Lipinski's Rule of Five, 3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid has 2 hydrogen bond donor(s) and 5 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-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid?
The CAS number of 3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid is 312290-27-0.
What is the molecular formula of 3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid?
The molecular formula of 3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid is C15H10N2O4S.
What is the molecular weight of 3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid?
The molecular weight of 3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid is 314.04 g/mol.
Where can I buy 3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid?
You can request a quote for 3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[5-[(E)-(2-imino-4-oxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.