![3-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid structure](/static/products/1014/101413-79-0.webp)
3-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid
TL;DR: 3-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid (CAS 101413-79-0) is a chemical compound with molecular formula C12H11N3O4S and molecular weight 293.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[2-(2-amino-4-oxo-1,3-thiazol-5-yl)acetyl]amino]benzoic acid
Also Known As: 3-[2-(2-amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid, 3-[[2-(2-amino-4-oxo-1,3-thiazol-5-yl)acetyl]amino]benzoic Acid, 2-Imino-thiazolid-4-on-5-yl-acetyl-3-amino-benzoesaeure, 3-{[(2-imino-4-oxo-1,3-thiazolidin-5-yl)acetyl]amino}benzoic acid, 3-[2-(2-imino-4-oxo-1,3-thiazolidin-5-yl)acetylamino]benzoic acid
| Molecular Formula | C12H11N3O4S |
|---|---|
| Molecular Weight | 293.05 g/mol |
| LogP | 0.6701 |
| Topological Polar Surface Area | 121.85 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.04703 |
| Heavy Atoms | 20 |
| Complexity | 614.4749 |
Chemical Identifiers
| CAS Number | 101413-79-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=O)CC2C(=O)N=C(S2)N)C(=O)O |
Product Overview
3-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid (CAS 101413-79-0), with molecular formula C12H11N3O4S and molecular weight 293.05 g/mol. IUPAC: 3-[[2-(2-amino-4-oxo-1,3-thiazol-5-yl)acetyl]amino]benzoic acid.
Chemical Property Profile of 3-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid
Property Insights of 3-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid
The XLogP value of 0.6701 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid. The TPSA of 121.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid. Following Lipinski's Rule of Five, 3-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid has 3 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-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid?
The CAS number of 3-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid is 101413-79-0.
What is the molecular formula of 3-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid?
The molecular formula of 3-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid is C12H11N3O4S.
What is the molecular weight of 3-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid?
The molecular weight of 3-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid is 293.05 g/mol.
Where can I buy 3-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid?
You can request a quote for 3-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]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-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamido]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.