1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone
TL;DR: 1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone (CAS 846582-53-4) is a chemical compound with molecular formula C14H15FN2OS and molecular weight 278.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-fluoro-1H-indol-3-yl)-2-thiomorpholin-4-ylethanone
Also Known As: 1-(5-fluoro-1H-indol-3-yl)-2-thiomorpholinoethanone, 1-(5-fluoro-1H-indol-3-yl)-2-thiomorpholin-4-yl-ethanone, 1-(5-fluoro-1H-indol-3-yl)-2-thiomorpholin-4-ylethanone, 1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone
| Molecular Formula | C14H15FN2OS |
|---|---|
| Molecular Weight | 278.09 g/mol |
| LogP | 2.5385 |
| Topological Polar Surface Area | 36.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.0889 |
| Heavy Atoms | 19 |
| Complexity | 604.51184 |
Chemical Identifiers
| CAS Number | 846582-53-4 |
|---|---|
| SMILES | C1CSCCN1CC(=O)C2=CNC3=C2C=C(C=C3)F |
Product Overview
1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone (CAS 846582-53-4), with molecular formula C14H15FN2OS and molecular weight 278.09 g/mol. IUPAC: 1-(5-fluoro-1H-indol-3-yl)-2-thiomorpholin-4-ylethanone.
Chemical Property Profile of 1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone
Property Insights of 1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone
The XLogP value of 2.5385 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone. With a topological polar surface area (TPSA) of 36.1 Ų, 1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone has 1 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 1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone?
The CAS number of 1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone is 846582-53-4.
What is the molecular formula of 1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone?
The molecular formula of 1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone is C14H15FN2OS.
What is the molecular weight of 1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone?
The molecular weight of 1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone is 278.09 g/mol.
Where can I buy 1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone?
You can request a quote for 1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-fluoro-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.