![3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid structure](/static/products/151/151163-25-6.webp)
3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid
TL;DR: 3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid (CAS 151163-25-6) is a chemical compound with molecular formula C15H13NO3S and molecular weight 287.0616 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(2-phenylsulfanylacetyl)amino]benzoic acid
Also Known As: 3-[(2-phenylsulfanylacetyl)amino]benzoic Acid, 3-{[(phenylthio)acetyl]amino}benzoic acid, 3-{[(phenylsulfanyl)acetyl]amino}benzoic acid
Technical Specifications
| Molecular Formula | C15H13NO3S |
| Molecular Weight | 287.0616 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 91.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 287.0616 Da |
| Heavy Atoms | 20 |
| Complexity | 342.0 |
| SMILES | C1=CC=C(C=C1)SCC(=O)NC2=CC=CC(=C2)C(=O)O |
| InChIKey | SXLFSWOLSWMUDS-UHFFFAOYSA-N |
Chemical Property Profile of 3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid
Property Insights of 3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid
The XLogP value of 3.6 indicates that 3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid. Following Lipinski's Rule of Five, 3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid?
The CAS number of 3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid is 151163-25-6.
What is the molecular formula of 3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid?
The molecular formula of 3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid is C15H13NO3S.
What is the molecular weight of 3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid?
The molecular weight of 3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid is 287.0616 g/mol.
Where can I buy 3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid?
You can request a quote for 3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid?
Yes, CoreyChem provides custom synthesis services for 3-{[(Phenylsulfanyl)acetyl]amino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.