Isoquinoline, 1-(1H-indol-3-yl)-
TL;DR: Isoquinoline, 1-(1H-indol-3-yl)- (CAS 13708-33-3) is a chemical compound with molecular formula C17H12N2 and molecular weight 244.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1H-indol-3-yl)isoquinoline
Also Known As: 1-(1H-indol-3-yl)isoquinoline, 1-(3-indolyl)isoquinoline, 1-(Indol-3-yl)isochinolin, Isoquinoline, 1-(1H-indol-3-yl)-, RefChem:349966
| Molecular Formula | C17H12N2 |
|---|---|
| Molecular Weight | 244.10 g/mol |
| LogP | 4.3831 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.10005 |
| Heavy Atoms | 19 |
| Complexity | 869.1063 |
Chemical Identifiers
| CAS Number | 13708-33-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CN=C2C3=CNC4=CC=CC=C43 |
Product Overview
Isoquinoline, 1-(1H-indol-3-yl)- (CAS 13708-33-3), with molecular formula C17H12N2 and molecular weight 244.10 g/mol. IUPAC: 1-(1H-indol-3-yl)isoquinoline.
Chemical Property Profile of Isoquinoline, 1-(1H-indol-3-yl)-
Property Insights of Isoquinoline, 1-(1H-indol-3-yl)-
The XLogP value of 4.3831 indicates that Isoquinoline, 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 28.68 Ų, Isoquinoline, 1-(1H-indol-3-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinoline, 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, 1-(1H-indol-3-yl)-?
The CAS number of Isoquinoline, 1-(1H-indol-3-yl)- is 13708-33-3.
What is the molecular formula of Isoquinoline, 1-(1H-indol-3-yl)-?
The molecular formula of Isoquinoline, 1-(1H-indol-3-yl)- is C17H12N2.
What is the molecular weight of Isoquinoline, 1-(1H-indol-3-yl)-?
The molecular weight of Isoquinoline, 1-(1H-indol-3-yl)- is 244.10 g/mol.
Where can I buy Isoquinoline, 1-(1H-indol-3-yl)-?
You can request a quote for Isoquinoline, 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, 1-(1H-indol-3-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Isoquinoline, 1-(1H-indol-3-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.