2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone
TL;DR: 2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone (CAS 450351-58-3) is a chemical compound with molecular formula C18H16N2OS and molecular weight 308.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dihydroindol-1-yl)-2-(1H-indol-3-ylsulfanyl)ethanone
Also Known As: IFLab1_002395, F0545-1369, 1-(1-indolinyl)-2-(3-indolylthio)-1-ethanone, 2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone, AB00668343-01
| Molecular Formula | C18H16N2OS |
|---|---|
| Molecular Weight | 308.10 g/mol |
| LogP | 3.8493 |
| Topological Polar Surface Area | 36.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.09833 |
| Heavy Atoms | 22 |
| Complexity | 839.72925 |
Chemical Identifiers
| CAS Number | 450351-58-3 |
|---|---|
| SMILES | C1CN(C2=CC=CC=C21)C(=O)CSC3=CNC4=CC=CC=C43 |
Product Overview
2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone (CAS 450351-58-3), with molecular formula C18H16N2OS and molecular weight 308.10 g/mol. IUPAC: 1-(2,3-dihydroindol-1-yl)-2-(1H-indol-3-ylsulfanyl)ethanone.
Chemical Property Profile of 2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone
Property Insights of 2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone
The XLogP value of 3.8493 indicates that 2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.1 Ų, 2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone has 1 hydrogen bond donor(s) and 2 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-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone?
The CAS number of 2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone is 450351-58-3.
What is the molecular formula of 2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone?
The molecular formula of 2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone is C18H16N2OS.
What is the molecular weight of 2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone?
The molecular weight of 2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone is 308.10 g/mol.
Where can I buy 2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone?
You can request a quote for 2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-((1H-indol-3-yl)thio)-1-(indolin-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.