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2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid
TL;DR: 2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid (CAS 23837-48-1) is a chemical compound with molecular formula C21H16O4S2 and molecular weight 396.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid
Also Known As: 2-[(2-carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid, 2,2'-[(Phenylmethylene)bis(sulfanediyl)]dibenzoic acid, 2-[(2-carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic ac
| Molecular Formula | C21H16O4S2 |
|---|---|
| Molecular Weight | 396.05 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 396.049 |
| Heavy Atoms | 27 |
| Complexity | 470.0 |
Chemical Identifiers
| CAS Number | 23837-48-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(SC2=CC=CC=C2C(=O)O)SC3=CC=CC=C3C(=O)O |
| InChIKey | SFOJQSLWNUVXEK-UHFFFAOYSA-N |
Product Overview
2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid (CAS 23837-48-1), with molecular formula C21H16O4S2 and molecular weight 396.05 g/mol. IUPAC: 2-[(2-carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid.
Chemical Property Profile of 2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid
Property Insights of 2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid
The XLogP value of 5.3 indicates that 2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid. Following Lipinski's Rule of Five, 2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid has 2 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 2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid?
The CAS number of 2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid is 23837-48-1.
What is the molecular formula of 2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid?
The molecular formula of 2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid is C21H16O4S2.
What is the molecular weight of 2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid?
The molecular weight of 2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid is 396.05 g/mol.
Where can I buy 2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid?
You can request a quote for 2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-Carboxyphenyl)sulfanyl-phenylmethyl]sulfanylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.