Ethanone, 1-(1H-indol-1-yl)-
TL;DR: Ethanone, 1-(1H-indol-1-yl)- (CAS 576-15-8) is a chemical compound with molecular formula C10H9NO and molecular weight 159.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-indol-1-ylethanone
Also Known As: 1-Acetylindole, N-Acetylindole, 1-indol-1-ylethanone, 1-(1H-indol-1-yl)ethanone, Acetylindole
| Molecular Formula | C10H9NO |
|---|---|
| Molecular Weight | 159.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 22.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 159.06842 |
| Heavy Atoms | 12 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 576-15-8 |
|---|---|
| SMILES | CC(=O)N1C=CC2=CC=CC=C21 |
| InChIKey | UUCUQJHYUPXDHN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanone, 1-(1H-indol-1-yl)- (CAS 576-15-8), with molecular formula C10H9NO and molecular weight 159.07 g/mol. IUPAC: 1-indol-1-ylethanone.
Chemical Property Profile of Ethanone, 1-(1H-indol-1-yl)-
Property Insights of Ethanone, 1-(1H-indol-1-yl)-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-(1H-indol-1-yl)-. With a topological polar surface area (TPSA) of 22.0 Ų, Ethanone, 1-(1H-indol-1-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-(1H-indol-1-yl)- has 0 hydrogen bond donor(s) and 1 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 Ethanone, 1-(1H-indol-1-yl)-?
The CAS number of Ethanone, 1-(1H-indol-1-yl)- is 576-15-8.
What is the molecular formula of Ethanone, 1-(1H-indol-1-yl)-?
The molecular formula of Ethanone, 1-(1H-indol-1-yl)- is C10H9NO.
What is the molecular weight of Ethanone, 1-(1H-indol-1-yl)-?
The molecular weight of Ethanone, 1-(1H-indol-1-yl)- is 159.07 g/mol.
Where can I buy Ethanone, 1-(1H-indol-1-yl)-?
You can request a quote for Ethanone, 1-(1H-indol-1-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-(1H-indol-1-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(1H-indol-1-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.