咪唑并(1,2-a)吡啶-3-乙腈
TL;DR: 咪唑并(1,2-a)吡啶-3-乙腈 (CAS 17744-98-8) is a chemical compound with molecular formula C9H7N3 and molecular weight 157.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
咪唑并(1,2-a)吡啶-3-乙腈
2-imidazo[1,2-a]pyridin-3-ylacetonitrile
Also Known As: Imidazo[1,2-a]pyridine-3-acetonitrile, 2-(Imidazo[1,2-a]pyridin-3-yl)acetonitrile, 3-Cyanomethylimidazo(1,2-a)pyridine, Imidazo(1,2-a)pyridine-3-acetonitrile, 2-imidazo[1,2-a]pyridin-3-ylacetonitrile
| Molecular Formula | C9H7N3 |
|---|---|
| Molecular Weight | 157.06 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 157.064 |
| Heavy Atoms | 12 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 17744-98-8 |
|---|---|
| SMILES | C1=CC2=NC=C(N2C=C1)CC#N |
| InChIKey | PJWDPOBWIWWXCP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
咪唑并(1,2-a)吡啶-3-乙腈 (CAS 17744-98-8), with molecular formula C9H7N3 and molecular weight 157.06 g/mol. IUPAC: 2-imidazo[1,2-a]pyridin-3-ylacetonitrile.
Chemical Property Profile of 咪唑并(1,2-a)吡啶-3-乙腈
Property Insights of 咪唑并(1,2-a)吡啶-3-乙腈
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 咪唑并(1,2-a)吡啶-3-乙腈. With a topological polar surface area (TPSA) of 41.1 Ų, 咪唑并(1,2-a)吡啶-3-乙腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 咪唑并(1,2-a)吡啶-3-乙腈 has 0 hydrogen bond donor(s) and 2 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 咪唑并(1,2-a)吡啶-3-乙腈?
The CAS number of 咪唑并(1,2-a)吡啶-3-乙腈 is 17744-98-8.
What is the molecular formula of 咪唑并(1,2-a)吡啶-3-乙腈?
The molecular formula of 咪唑并(1,2-a)吡啶-3-乙腈 is C9H7N3.
What is the molecular weight of 咪唑并(1,2-a)吡啶-3-乙腈?
The molecular weight of 咪唑并(1,2-a)吡啶-3-乙腈 is 157.06 g/mol.
Where can I buy 咪唑并(1,2-a)吡啶-3-乙腈?
You can request a quote for 咪唑并(1,2-a)吡啶-3-乙腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 咪唑并(1,2-a)吡啶-3-乙腈?
Yes, KEHONG BIO provides custom synthesis services for 咪唑并(1,2-a)吡啶-3-乙腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.