![3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid structure](/static/products/1735/173558-03-7.webp)
3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid
TL;DR: 3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid (CAS 173558-03-7) is a chemical compound with molecular formula C25H24N2O4S2 and molecular weight 480.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-bis[(2-benzylsulfanylacetyl)amino]benzoic acid
Also Known As: 3,4-bis(2-(benzylthio)acetamido)benzoic acid, 3,4-bis[(2-benzylsulfanylacetyl)amino]benzoic Acid, 3,4-bis{[(benzylsulfanyl)acetyl]amino}benzoic acid
| Molecular Formula | C25H24N2O4S2 |
|---|---|
| Molecular Weight | 480.12 g/mol |
| LogP | 5.1286 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 480.11774 |
| Heavy Atoms | 33 |
| Complexity | 1092.0758 |
Chemical Identifiers
| CAS Number | 173558-03-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSCC(=O)NC2=C(C=C(C=C2)C(=O)O)NC(=O)CSCC3=CC=CC=C3 |
Product Overview
3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid (CAS 173558-03-7), with molecular formula C25H24N2O4S2 and molecular weight 480.12 g/mol. IUPAC: 3,4-bis[(2-benzylsulfanylacetyl)amino]benzoic acid.
Chemical Property Profile of 3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid
Property Insights of 3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid
The XLogP value of 5.1286 indicates that 3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid. Following Lipinski's Rule of Five, 3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid?
The CAS number of 3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid is 173558-03-7.
What is the molecular formula of 3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid?
The molecular formula of 3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid is C25H24N2O4S2.
What is the molecular weight of 3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid?
The molecular weight of 3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid is 480.12 g/mol.
Where can I buy 3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid?
You can request a quote for 3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Bis{[(benzylsulfanyl)acetyl]amino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.