1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline
TL;DR: 1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline (CAS 104372-31-8) is a chemical compound with molecular formula C31H22N2 and molecular weight 422.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4,5-triphenyl-1H-pyrrol-2-yl)isoquinoline
Also Known As: 1-(3,4,5-triphenyl-1h-pyrrol-2-yl)isoquinoline, KST-1A9698, 2-(1-Isochinolyl)-3,4,5-triphenylpyrrol, Isoquinoline,1-(3,4,5-triphenyl-1H-pyrrol-2-yl)-
| Molecular Formula | C31H22N2 |
|---|---|
| Molecular Weight | 422.18 g/mol |
| LogP | 7.5 |
| Topological Polar Surface Area | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 422.17828 |
| Heavy Atoms | 33 |
| Complexity | 600.0 |
Chemical Identifiers
| CAS Number | 104372-31-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(NC(=C2C3=CC=CC=C3)C4=NC=CC5=CC=CC=C54)C6=CC=CC=C6 |
| InChIKey | VGJFVAPAEXMESO-UHFFFAOYSA-N |
Product Overview
1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline (CAS 104372-31-8), with molecular formula C31H22N2 and molecular weight 422.18 g/mol. IUPAC: 1-(3,4,5-triphenyl-1H-pyrrol-2-yl)isoquinoline.
Chemical Property Profile of 1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline
Property Insights of 1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline
The XLogP value of 7.5 indicates that 1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.7 Ų, 1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline?
The CAS number of 1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline is 104372-31-8.
What is the molecular formula of 1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline?
The molecular formula of 1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline is C31H22N2.
What is the molecular weight of 1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline?
The molecular weight of 1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline is 422.18 g/mol.
Where can I buy 1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline?
You can request a quote for 1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4,5-Triphenyl-1h-pyrrol-2-yl)isoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.