![3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione structure](/static/products/3013/301307-89-1.webp)
3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione
TL;DR: 3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione (CAS 301307-89-1) is a chemical compound with molecular formula C18H14F3NO2S and molecular weight 365.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methylphenyl)sulfanyl-1-[2-(trifluoromethyl)phenyl]pyrrolidine-2,5-dione
Also Known As: BIM-0027229.P001, 3-[(4-methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione, 3-(p-tolylthio)-1-(2-(trifluoromethyl)phenyl)pyrrolidine-2,5-dione, F0222-0013, 3-[(4-methylphenyl)sulfanyl]-1-[2-(trifluoromethyl)phenyl]pyrrolidine-2,5-dione
| Molecular Formula | C18H14F3NO2S |
|---|---|
| Molecular Weight | 365.07 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 62.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 365.06973 |
| Heavy Atoms | 25 |
| Complexity | 517.0 |
Chemical Identifiers
| CAS Number | 301307-89-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SC2CC(=O)N(C2=O)C3=CC=CC=C3C(F)(F)F |
| InChIKey | AISHFLRCJDHOBO-UHFFFAOYSA-N |
Product Overview
3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione (CAS 301307-89-1), with molecular formula C18H14F3NO2S and molecular weight 365.07 g/mol. IUPAC: 3-(4-methylphenyl)sulfanyl-1-[2-(trifluoromethyl)phenyl]pyrrolidine-2,5-dione.
Chemical Property Profile of 3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione
Property Insights of 3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione
The XLogP value of 4.3 indicates that 3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione. Following Lipinski's Rule of Five, 3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione has 0 hydrogen bond donor(s) and 6 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 3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione?
The CAS number of 3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione is 301307-89-1.
What is the molecular formula of 3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione?
The molecular formula of 3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione is C18H14F3NO2S.
What is the molecular weight of 3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione?
The molecular weight of 3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione is 365.07 g/mol.
Where can I buy 3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione?
You can request a quote for 3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-Methylphenyl)thio]-1-[2-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.