4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid
TL;DR: 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid (CAS 124243-00-1) is a chemical compound with molecular formula C25H24O7S2 and molecular weight 500.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(4-methylphenyl)sulfonyl-2-[(4-methylphenyl)sulfonylmethyl]propanoyl]benzoic acid
Also Known As: 4-(3-tosyl-2-(tosylmethyl)propanoyl)benzoic acid, Bis-sulfone Acid, nchembio786-comp1, 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoicacid, Benzoic acid,4-[3-[(4-methylphenyl)sulfonyl]-2-[[(4-methylphenyl)sulfonyl]methyl]-1-oxopropyl]-
| Molecular Formula | C25H24O7S2 |
|---|---|
| Molecular Weight | 500.10 g/mol |
| LogP | 3.74834 |
| Topological Polar Surface Area | 122.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 500.09634 |
| Heavy Atoms | 34 |
| Complexity | 1326.5894 |
Chemical Identifiers
| CAS Number | 124243-00-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)CC(CS(=O)(=O)C2=CC=C(C=C2)C)C(=O)C3=CC=C(C=C3)C(=O)O |
Product Overview
4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid (CAS 124243-00-1), with molecular formula C25H24O7S2 and molecular weight 500.10 g/mol. IUPAC: 4-[3-(4-methylphenyl)sulfonyl-2-[(4-methylphenyl)sulfonylmethyl]propanoyl]benzoic acid.
Chemical Property Profile of 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid
Property Insights of 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid
The XLogP value of 3.74834 indicates that 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid. Following Lipinski's Rule of Five, 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid?
The CAS number of 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid is 124243-00-1.
What is the molecular formula of 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid?
The molecular formula of 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid is C25H24O7S2.
What is the molecular weight of 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid?
The molecular weight of 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid is 500.10 g/mol.
Where can I buy 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid?
You can request a quote for 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.