2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid
TL;DR: 2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid (CAS 303033-67-2) is a chemical compound with molecular formula C18H15NO4S2 and molecular weight 373.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(2-methylsulfanylphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylbenzoic acid
Also Known As: ChemDiv3_002224, BAS 01833816, AF-399/15392002, 2-({1-[2-(methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid, BRD-A18582925-001-01-4
| Molecular Formula | C18H15NO4S2 |
|---|---|
| Molecular Weight | 373.04 g/mol |
| LogP | 3.5309 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.04425 |
| Heavy Atoms | 25 |
| Complexity | 852.4746 |
Chemical Identifiers
| CAS Number | 303033-67-2 |
|---|---|
| SMILES | CSC1=CC=CC=C1N2C(=O)CC(C2=O)SC3=CC=CC=C3C(=O)O |
Product Overview
2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid (CAS 303033-67-2), with molecular formula C18H15NO4S2 and molecular weight 373.04 g/mol. IUPAC: 2-[1-(2-methylsulfanylphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylbenzoic acid.
Chemical Property Profile of 2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid
Property Insights of 2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid
The XLogP value of 3.5309 indicates that 2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid. Following Lipinski's Rule of Five, 2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid has 1 hydrogen bond donor(s) and 5 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 2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid?
The CAS number of 2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid is 303033-67-2.
What is the molecular formula of 2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid?
The molecular formula of 2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid is C18H15NO4S2.
What is the molecular weight of 2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid?
The molecular weight of 2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid is 373.04 g/mol.
Where can I buy 2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid?
You can request a quote for 2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-({1-[2-(Methylsulfanyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.