![Pyrrolo[2,1-a]isoquinoline-1-carbonitrile structure](/static/products/247/247075-91-8.png)
Pyrrolo[2,1-a]isoquinoline-1-carbonitrile
TL;DR: Pyrrolo[2,1-a]isoquinoline-1-carbonitrile (CAS 247075-91-8) is a chemical compound with molecular formula C13H8N2 and molecular weight 192.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pyrrolo[2,1-a]isoquinoline-1-carbonitrile
Also Known As: pyrrolo[2,1-a]isoquinoline-1-carbonitrile, J1.212.308F
| Molecular Formula | C13H8N2 |
|---|---|
| Molecular Weight | 192.07 g/mol |
| LogP | 2.96418 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 192.06874 |
| Heavy Atoms | 15 |
| Complexity | 686.3851 |
Chemical Identifiers
| CAS Number | 247075-91-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CN3C2=C(C=C3)C#N |
Product Overview
Pyrrolo[2,1-a]isoquinoline-1-carbonitrile (CAS 247075-91-8), with molecular formula C13H8N2 and molecular weight 192.07 g/mol. IUPAC: pyrrolo[2,1-a]isoquinoline-1-carbonitrile.
Chemical Property Profile of Pyrrolo[2,1-a]isoquinoline-1-carbonitrile
Property Insights of Pyrrolo[2,1-a]isoquinoline-1-carbonitrile
The XLogP value of 2.96418 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolo[2,1-a]isoquinoline-1-carbonitrile. With a topological polar surface area (TPSA) of 28.2 Ų, Pyrrolo[2,1-a]isoquinoline-1-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolo[2,1-a]isoquinoline-1-carbonitrile 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 Pyrrolo[2,1-a]isoquinoline-1-carbonitrile?
The CAS number of Pyrrolo[2,1-a]isoquinoline-1-carbonitrile is 247075-91-8.
What is the molecular formula of Pyrrolo[2,1-a]isoquinoline-1-carbonitrile?
The molecular formula of Pyrrolo[2,1-a]isoquinoline-1-carbonitrile is C13H8N2.
What is the molecular weight of Pyrrolo[2,1-a]isoquinoline-1-carbonitrile?
The molecular weight of Pyrrolo[2,1-a]isoquinoline-1-carbonitrile is 192.07 g/mol.
Where can I buy Pyrrolo[2,1-a]isoquinoline-1-carbonitrile?
You can request a quote for Pyrrolo[2,1-a]isoquinoline-1-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolo[2,1-a]isoquinoline-1-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolo[2,1-a]isoquinoline-1-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.