2-(2-Nitrophenylthio)isoindoline-1,3-dione
TL;DR: 2-(2-Nitrophenylthio)isoindoline-1,3-dione (CAS 61639-74-5) 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-(2-nitrophenyl)sulfanylisoindole-1,3-dione
Also Known As: 2-(2-nitrophenylthio)isoindoline-1,3-dione, N-(2-Nitrophenylthio)phthalimide, N-2-nitrophenylsulfenylphthalimide, N-(2-nitrophenylthio) phthalimide, 2-(2-nitrophenyl)sulfanylisoindole-1,3-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 | 61639-74-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)SC3=CC=CC=C3[N+](=O)[O-] |
Product Overview
2-(2-Nitrophenylthio)isoindoline-1,3-dione (CAS 61639-74-5), with molecular formula C14H8N2O4S and molecular weight 300.02 g/mol. IUPAC: 2-(2-nitrophenyl)sulfanylisoindole-1,3-dione.
Chemical Property Profile of 2-(2-Nitrophenylthio)isoindoline-1,3-dione
Property Insights of 2-(2-Nitrophenylthio)isoindoline-1,3-dione
The XLogP value of 2.8981 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Nitrophenylthio)isoindoline-1,3-dione. The TPSA of 80.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Nitrophenylthio)isoindoline-1,3-dione. Following Lipinski's Rule of Five, 2-(2-Nitrophenylthio)isoindoline-1,3-dione 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 2-(2-Nitrophenylthio)isoindoline-1,3-dione?
The CAS number of 2-(2-Nitrophenylthio)isoindoline-1,3-dione is 61639-74-5.
What is the molecular formula of 2-(2-Nitrophenylthio)isoindoline-1,3-dione?
The molecular formula of 2-(2-Nitrophenylthio)isoindoline-1,3-dione is C14H8N2O4S.
What is the molecular weight of 2-(2-Nitrophenylthio)isoindoline-1,3-dione?
The molecular weight of 2-(2-Nitrophenylthio)isoindoline-1,3-dione is 300.02 g/mol.
Where can I buy 2-(2-Nitrophenylthio)isoindoline-1,3-dione?
You can request a quote for 2-(2-Nitrophenylthio)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-(2-Nitrophenylthio)isoindoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Nitrophenylthio)isoindoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.