N-((2-Cyanoethyl)thio)phthalimide
TL;DR: N-((2-Cyanoethyl)thio)phthalimide (CAS 88683-57-2) is a chemical compound with molecular formula C11H8N2O2S and molecular weight 232.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-dioxoisoindol-2-yl)sulfanylpropanenitrile
Also Known As: N-[(2-Cyanoethyl)thio]phthalimide, 3-((1,3-Dioxoisoindolin-2-yl)thio)propanenitrile, 3-(1,3-dioxoisoindol-2-yl)sulfanylpropanenitrile, N-( PHTHALIMIDE98, N-(2-Cyanoethylthio)phthalimide
| Molecular Formula | C11H8N2O2S |
|---|---|
| Molecular Weight | 232.03 g/mol |
| LogP | 1.84448 |
| Topological Polar Surface Area | 61.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.03065 |
| Heavy Atoms | 16 |
| Complexity | 458.00308 |
Chemical Identifiers
| CAS Number | 88683-57-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)SCCC#N |
Product Overview
N-((2-Cyanoethyl)thio)phthalimide (CAS 88683-57-2), with molecular formula C11H8N2O2S and molecular weight 232.03 g/mol. IUPAC: 3-(1,3-dioxoisoindol-2-yl)sulfanylpropanenitrile.
Chemical Property Profile of N-((2-Cyanoethyl)thio)phthalimide
Property Insights of N-((2-Cyanoethyl)thio)phthalimide
The XLogP value of 1.84448 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-((2-Cyanoethyl)thio)phthalimide. The TPSA of 61.17 Ų falls within the moderate polarity range, balancing permeability and solubility for N-((2-Cyanoethyl)thio)phthalimide. Following Lipinski's Rule of Five, N-((2-Cyanoethyl)thio)phthalimide has 0 hydrogen bond donor(s) and 4 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 N-((2-Cyanoethyl)thio)phthalimide?
The CAS number of N-((2-Cyanoethyl)thio)phthalimide is 88683-57-2.
What is the molecular formula of N-((2-Cyanoethyl)thio)phthalimide?
The molecular formula of N-((2-Cyanoethyl)thio)phthalimide is C11H8N2O2S.
What is the molecular weight of N-((2-Cyanoethyl)thio)phthalimide?
The molecular weight of N-((2-Cyanoethyl)thio)phthalimide is 232.03 g/mol.
Where can I buy N-((2-Cyanoethyl)thio)phthalimide?
You can request a quote for N-((2-Cyanoethyl)thio)phthalimide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((2-Cyanoethyl)thio)phthalimide?
Yes, KEHONG BIO provides custom synthesis services for N-((2-Cyanoethyl)thio)phthalimide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.