2-(Methylthio)isoindoline-1,3-dione
TL;DR: 2-(Methylthio)isoindoline-1,3-dione (CAS 40167-20-2) is a chemical compound with molecular formula C9H7NO2S and molecular weight 193.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanylisoindole-1,3-dione
Also Known As: 2-(methylthio)isoindoline-1,3-dione, n-(methylthio)phthalimide, S-methyl-N-thiophthalimide, 2-methylsulfanylisoindole-1,3-dione, N-(METHYLTHIO)PHTHALIMIDE 97
| Molecular Formula | C9H7NO2S |
|---|---|
| Molecular Weight | 193.02 g/mol |
| LogP | 1.5606 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.01974 |
| Heavy Atoms | 13 |
| Complexity | 353.95602 |
Chemical Identifiers
| CAS Number | 40167-20-2 |
|---|---|
| SMILES | CSN1C(=O)C2=CC=CC=C2C1=O |
Product Overview
2-(Methylthio)isoindoline-1,3-dione (CAS 40167-20-2), with molecular formula C9H7NO2S and molecular weight 193.02 g/mol. IUPAC: 2-methylsulfanylisoindole-1,3-dione.
Chemical Property Profile of 2-(Methylthio)isoindoline-1,3-dione
Property Insights of 2-(Methylthio)isoindoline-1,3-dione
The XLogP value of 1.5606 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Methylthio)isoindoline-1,3-dione. With a topological polar surface area (TPSA) of 37.38 Ų, 2-(Methylthio)isoindoline-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Methylthio)isoindoline-1,3-dione has 0 hydrogen bond donor(s) and 3 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-(Methylthio)isoindoline-1,3-dione?
The CAS number of 2-(Methylthio)isoindoline-1,3-dione is 40167-20-2.
What is the molecular formula of 2-(Methylthio)isoindoline-1,3-dione?
The molecular formula of 2-(Methylthio)isoindoline-1,3-dione is C9H7NO2S.
What is the molecular weight of 2-(Methylthio)isoindoline-1,3-dione?
The molecular weight of 2-(Methylthio)isoindoline-1,3-dione is 193.02 g/mol.
Where can I buy 2-(Methylthio)isoindoline-1,3-dione?
You can request a quote for 2-(Methylthio)isoindoline-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methylthio)isoindoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methylthio)isoindoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.