6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline
TL;DR: 6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline (CAS 340302-81-0) is a chemical compound with molecular formula C15H14N2 and molecular weight 222.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2,5-dimethylpyrrol-1-yl)isoquinoline
Also Known As: 6-(2,5-dimethylpyrrol-1-yl)isoquinoline, 6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline, BAS 06615347, 6-(2,5-Dimethyl-pyrrol-1-yl)-isoquinoline, AH-487/15148016
| Molecular Formula | C15H14N2 |
|---|---|
| Molecular Weight | 222.12 g/mol |
| LogP | 3.64234 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.11569 |
| Heavy Atoms | 17 |
| Complexity | 660.7046 |
Chemical Identifiers
| CAS Number | 340302-81-0 |
|---|---|
| SMILES | CC1=CC=C(N1C2=CC3=C(C=C2)C=NC=C3)C |
Product Overview
6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline (CAS 340302-81-0), with molecular formula C15H14N2 and molecular weight 222.12 g/mol. IUPAC: 6-(2,5-dimethylpyrrol-1-yl)isoquinoline.
Chemical Property Profile of 6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline
Property Insights of 6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline
The XLogP value of 3.64234 indicates that 6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.82 Ų, 6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline 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 6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline?
The CAS number of 6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline is 340302-81-0.
What is the molecular formula of 6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline?
The molecular formula of 6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline is C15H14N2.
What is the molecular weight of 6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline?
The molecular weight of 6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline is 222.12 g/mol.
Where can I buy 6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline?
You can request a quote for 6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 6-(2,5-dimethyl-1H-pyrrol-1-yl)isoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.