![6-Methoxy-3-methyl-1H-benzo[de]cinnoline structure](/static/products/800/80099-15-6.png)
6-Methoxy-3-methyl-1H-benzo[de]cinnoline
TL;DR: 6-Methoxy-3-methyl-1H-benzo[de]cinnoline (CAS 80099-15-6) is a chemical compound with molecular formula C13H12N2O and molecular weight 212.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-methoxy-4-methyl-2,3-diazatricyclo[7.3.1.05,13]trideca-1(12),3,5(13),6,8,10-hexaene
Also Known As: 6-Methoxy-3-methyl-1H-benzo[de]cinnoline, BAS 01269402, 6-methoxy-3-methyl-1h-1,2-diazaphenalene
| Molecular Formula | C13H12N2O |
|---|---|
| Molecular Weight | 212.09 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 33.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 212.09496 |
| Heavy Atoms | 16 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 80099-15-6 |
|---|---|
| SMILES | CC1=NNC2=CC=CC3=C(C=CC1=C32)OC |
| InChIKey | MXCNJRIUQVTTPS-UHFFFAOYSA-N |
Product Overview
6-Methoxy-3-methyl-1H-benzo[de]cinnoline (CAS 80099-15-6), with molecular formula C13H12N2O and molecular weight 212.09 g/mol. IUPAC: 8-methoxy-4-methyl-2,3-diazatricyclo[7.3.1.05,13]trideca-1(12),3,5(13),6,8,10-hexaene.
Chemical Property Profile of 6-Methoxy-3-methyl-1H-benzo[de]cinnoline
Property Insights of 6-Methoxy-3-methyl-1H-benzo[de]cinnoline
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methoxy-3-methyl-1H-benzo[de]cinnoline. With a topological polar surface area (TPSA) of 33.6 Ų, 6-Methoxy-3-methyl-1H-benzo[de]cinnoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methoxy-3-methyl-1H-benzo[de]cinnoline has 1 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 6-Methoxy-3-methyl-1H-benzo[de]cinnoline?
The CAS number of 6-Methoxy-3-methyl-1H-benzo[de]cinnoline is 80099-15-6.
What is the molecular formula of 6-Methoxy-3-methyl-1H-benzo[de]cinnoline?
The molecular formula of 6-Methoxy-3-methyl-1H-benzo[de]cinnoline is C13H12N2O.
What is the molecular weight of 6-Methoxy-3-methyl-1H-benzo[de]cinnoline?
The molecular weight of 6-Methoxy-3-methyl-1H-benzo[de]cinnoline is 212.09 g/mol.
Where can I buy 6-Methoxy-3-methyl-1H-benzo[de]cinnoline?
You can request a quote for 6-Methoxy-3-methyl-1H-benzo[de]cinnoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methoxy-3-methyl-1H-benzo[de]cinnoline?
Yes, KEHONG BIO provides custom synthesis services for 6-Methoxy-3-methyl-1H-benzo[de]cinnoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.