![1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]- structure](/static/products/886/88683-46-9.png)
1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]-
TL;DR: 1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]- (CAS 88683-46-9) is a chemical compound with molecular formula C14H8N2O4S and molecular weight 300.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-nitrophenyl)sulfanylisoindole-1,3-dione
Also Known As: 1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]-, 2-(3-nitrophenyl)sulfanylisoindole-1,3-dione, 2-[(3-Nitrophenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C14H8N2O4S |
|---|---|
| Molecular Weight | 300.02 g/mol |
| LogP | 2.8981 |
| Topological Polar Surface Area | 80.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 300.02048 |
| Heavy Atoms | 21 |
| Complexity | 740.0743 |
Chemical Identifiers
| CAS Number | 88683-46-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)SC3=CC=CC(=C3)[N+](=O)[O-] |
Product Overview
1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]- (CAS 88683-46-9), with molecular formula C14H8N2O4S and molecular weight 300.02 g/mol. IUPAC: 2-(3-nitrophenyl)sulfanylisoindole-1,3-dione.
Chemical Property Profile of 1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]-
Property Insights of 1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]-
The XLogP value of 2.8981 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]-. The TPSA of 80.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]-. Following Lipinski's Rule of Five, 1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]- has 0 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 1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]-?
The CAS number of 1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]- is 88683-46-9.
What is the molecular formula of 1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]-?
The molecular formula of 1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]- is C14H8N2O4S.
What is the molecular weight of 1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]-?
The molecular weight of 1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]- is 300.02 g/mol.
Where can I buy 1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]-?
You can request a quote for 1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.