![2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione structure](/static/products/775/77548-43-7.png)
2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione
TL;DR: 2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione (CAS 77548-43-7) is a chemical compound with molecular formula C16H13NO2S and molecular weight 283.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,5-dimethylphenyl)sulfanylisoindole-1,3-dione
Also Known As: 2-(2,5-dimethylphenyl)sulfanylisoindole-1,3-dione, 2-((2,5-dimethylphenyl)thio)isoindoline-1,3-dione, 2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C16H13NO2S |
|---|---|
| Molecular Weight | 283.07 g/mol |
| LogP | 3.60674 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 283.0667 |
| Heavy Atoms | 20 |
| Complexity | 689.1669 |
Chemical Identifiers
| CAS Number | 77548-43-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)SN2C(=O)C3=CC=CC=C3C2=O |
Product Overview
2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione (CAS 77548-43-7), with molecular formula C16H13NO2S and molecular weight 283.07 g/mol. IUPAC: 2-(2,5-dimethylphenyl)sulfanylisoindole-1,3-dione.
Chemical Property Profile of 2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione
Property Insights of 2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione
The XLogP value of 3.60674 indicates that 2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.38 Ų, 2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-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-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione?
The CAS number of 2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione is 77548-43-7.
What is the molecular formula of 2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione?
The molecular formula of 2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione is C16H13NO2S.
What is the molecular weight of 2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione?
The molecular weight of 2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione is 283.07 g/mol.
Where can I buy 2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione?
You can request a quote for 2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2,5-dimethylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.