![5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid structure](/static/products/3133/313397-80-7.webp)
5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid
TL;DR: 5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid (CAS 313397-80-7) is a chemical compound with molecular formula C16H12N2O5S and molecular weight 344.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid
Also Known As: 5-(2-benzoxazol-2-ylthioacetylamino)-2-hydroxybenzoic acid, 5-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid, 5-[(2-benzooxazol-2-ylsulfanylacetyl)amino]-2-hydroxy-benzoic Acid, 5-{[(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino}-2-hydroxybenzoic acid
| Molecular Formula | C16H12N2O5S |
|---|---|
| Molecular Weight | 344.05 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 344.0467 |
| Heavy Atoms | 24 |
| Complexity | 477.0 |
Chemical Identifiers
| CAS Number | 313397-80-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(O2)SCC(=O)NC3=CC(=C(C=C3)O)C(=O)O |
| InChIKey | IWOOZMBLTBYBAD-UHFFFAOYSA-N |
Product Overview
5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid (CAS 313397-80-7), with molecular formula C16H12N2O5S and molecular weight 344.05 g/mol. IUPAC: 5-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid.
Chemical Property Profile of 5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid
Property Insights of 5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid
The XLogP value of 3.2 indicates that 5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid. Following Lipinski's Rule of Five, 5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid has 3 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 5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid?
The CAS number of 5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid is 313397-80-7.
What is the molecular formula of 5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid?
The molecular formula of 5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid is C16H12N2O5S.
What is the molecular weight of 5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid?
The molecular weight of 5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid is 344.05 g/mol.
Where can I buy 5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid?
You can request a quote for 5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-[[2-(1,3-Benzoxazol-2-ylsulfanyl)acetyl]amino]-2-hydroxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.