Indol-4(5H)-one, 3-acetyl-6,7-dihydro-
TL;DR: Indol-4(5H)-one, 3-acetyl-6,7-dihydro- (CAS 22056-54-8) is a chemical compound with molecular formula C10H11NO2 and molecular weight 177.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyl-1,5,6,7-tetrahydroindol-4-one
Also Known As: 3-Acetyl-6,7-dihydro-indol-4(5H)-one, 4,5,6,7-Tetrahydro-3-methyl-4-oxoindole, INDOL-4(5H)-ONE, 3-ACETYL-6,7-DIHYDRO-, 3-acetyl-1,5,6,7-tetrahydroindol-4-one, 3-acetyl-1,5,6,7-tetrahydro-4H-indol-4-one
| Molecular Formula | C10H11NO2 |
|---|---|
| Molecular Weight | 177.08 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 49.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 177.07898 |
| Heavy Atoms | 13 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 22056-54-8 |
|---|---|
| SMILES | CC(=O)C1=CNC2=C1C(=O)CCC2 |
| InChIKey | DJVGTOGEQZBUAS-UHFFFAOYSA-N |
Product Overview
Indol-4(5H)-one, 3-acetyl-6,7-dihydro- (CAS 22056-54-8), with molecular formula C10H11NO2 and molecular weight 177.08 g/mol. IUPAC: 3-acetyl-1,5,6,7-tetrahydroindol-4-one.
Chemical Property Profile of Indol-4(5H)-one, 3-acetyl-6,7-dihydro-
Property Insights of Indol-4(5H)-one, 3-acetyl-6,7-dihydro-
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Indol-4(5H)-one, 3-acetyl-6,7-dihydro-. With a topological polar surface area (TPSA) of 49.9 Ų, Indol-4(5H)-one, 3-acetyl-6,7-dihydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indol-4(5H)-one, 3-acetyl-6,7-dihydro- 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 Indol-4(5H)-one, 3-acetyl-6,7-dihydro-?
The CAS number of Indol-4(5H)-one, 3-acetyl-6,7-dihydro- is 22056-54-8.
What is the molecular formula of Indol-4(5H)-one, 3-acetyl-6,7-dihydro-?
The molecular formula of Indol-4(5H)-one, 3-acetyl-6,7-dihydro- is C10H11NO2.
What is the molecular weight of Indol-4(5H)-one, 3-acetyl-6,7-dihydro-?
The molecular weight of Indol-4(5H)-one, 3-acetyl-6,7-dihydro- is 177.08 g/mol.
Where can I buy Indol-4(5H)-one, 3-acetyl-6,7-dihydro-?
You can request a quote for Indol-4(5H)-one, 3-acetyl-6,7-dihydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indol-4(5H)-one, 3-acetyl-6,7-dihydro-?
Yes, KEHONG BIO provides custom synthesis services for Indol-4(5H)-one, 3-acetyl-6,7-dihydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.