3-Methoxycinnoline
TL;DR: 3-Methoxycinnoline (CAS 17372-80-4) is a chemical compound with molecular formula C9H8N2O and molecular weight 160.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxycinnoline
Also Known As: 3-methoxycinnoline, methoxycinnoline, Cinnoline, 3-methoxy-, Maybridge3_003436, 3-Cinnolinyl methyl ether #
| Molecular Formula | C9H8N2O |
|---|---|
| Molecular Weight | 160.06 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 35.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.06366 |
| Heavy Atoms | 12 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 17372-80-4 |
|---|---|
| SMILES | COC1=CC2=CC=CC=C2N=N1 |
| InChIKey | XZPZVFAARDDFLG-UHFFFAOYSA-N |
Product Overview
3-Methoxycinnoline (CAS 17372-80-4), with molecular formula C9H8N2O and molecular weight 160.06 g/mol. IUPAC: 3-methoxycinnoline.
Chemical Property Profile of 3-Methoxycinnoline
Property Insights of 3-Methoxycinnoline
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxycinnoline. With a topological polar surface area (TPSA) of 35.0 Ų, 3-Methoxycinnoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methoxycinnoline has 0 hydrogen bond donor(s) and 3 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 3-Methoxycinnoline?
The CAS number of 3-Methoxycinnoline is 17372-80-4.
What is the molecular formula of 3-Methoxycinnoline?
The molecular formula of 3-Methoxycinnoline is C9H8N2O.
What is the molecular weight of 3-Methoxycinnoline?
The molecular weight of 3-Methoxycinnoline is 160.06 g/mol.
Where can I buy 3-Methoxycinnoline?
You can request a quote for 3-Methoxycinnoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxycinnoline?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxycinnoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.