Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)-
TL;DR: Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)- (CAS 71999-22-9) is a chemical compound with molecular formula C19H16N2O and molecular weight 288.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-(1H-indol-3-yl)-1H-isoquinolin-2-yl]ethanone
Also Known As: Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)-, 1-(1-(1H-Indol-3-yl)isoquinolin-2(1H)-yl)ethanone, 1-[1-(1H-indol-3-yl)-1H-isoquinolin-2-yl]ethanone, 1-[1-(1H-indol-3-yl)isoquinolin-2(1H)-yl]ethanone, 1-[1-(1H-Indol-3-yl)isoquinolin-2(1H)-yl]ethan-1-one
| Molecular Formula | C19H16N2O |
|---|---|
| Molecular Weight | 288.13 g/mol |
| LogP | 4.0901 |
| Topological Polar Surface Area | 36.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 288.12625 |
| Heavy Atoms | 22 |
| Complexity | 891.0964 |
Chemical Identifiers
| CAS Number | 71999-22-9 |
|---|---|
| SMILES | CC(=O)N1C=CC2=CC=CC=C2C1C3=CNC4=CC=CC=C43 |
Product Overview
Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)- (CAS 71999-22-9), with molecular formula C19H16N2O and molecular weight 288.13 g/mol. IUPAC: 1-[1-(1H-indol-3-yl)-1H-isoquinolin-2-yl]ethanone.
Chemical Property Profile of Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)-
Property Insights of Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)-
The XLogP value of 4.0901 indicates that Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.1 Ų, Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)- has 1 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 Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)-?
The CAS number of Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)- is 71999-22-9.
What is the molecular formula of Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)-?
The molecular formula of Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)- is C19H16N2O.
What is the molecular weight of Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)-?
The molecular weight of Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)- is 288.13 g/mol.
Where can I buy Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)-?
You can request a quote for Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Isoquinoline, 2-acetyl-1,2-dihydro-1-(1H-indol-3-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.