5-Methoxycanthin-6-one
TL;DR: 5-Methoxycanthin-6-one (CAS 15114-79-1) is a chemical compound with molecular formula C15H10N2O2 and molecular weight 250.07423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methoxy-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-3,5(16),6,8,10,12,14-heptaen-2-one
Also Known As: 5-Methoxycanthin-6-one, 5-Methoxycanthinone, methoxy[?]one, 5-Methoxy-Canthin-6-one, Alkaloid PA-1
Technical Specifications
| Molecular Formula | C15H10N2O2 |
| Molecular Weight | 250.07423 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 44.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 250.07423 Da |
| Heavy Atoms | 19 |
| Complexity | 434.0 |
| SMILES | COC1=CC2=NC=CC3=C2N(C1=O)C4=CC=CC=C34 |
| InChIKey | TXEFUSAHPIYZHD-UHFFFAOYSA-N |
Chemical Property Profile of 5-Methoxycanthin-6-one
Property Insights of 5-Methoxycanthin-6-one
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methoxycanthin-6-one. With a topological polar surface area (TPSA) of 44.1 Ų, 5-Methoxycanthin-6-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methoxycanthin-6-one 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
What is the CAS number of 5-Methoxycanthin-6-one?
The CAS number of 5-Methoxycanthin-6-one is 15114-79-1.
What is the molecular formula of 5-Methoxycanthin-6-one?
The molecular formula of 5-Methoxycanthin-6-one is C15H10N2O2.
What is the molecular weight of 5-Methoxycanthin-6-one?
The molecular weight of 5-Methoxycanthin-6-one is 250.07423 g/mol.
Where can I buy 5-Methoxycanthin-6-one?
You can request a quote for 5-Methoxycanthin-6-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Methoxycanthin-6-one?
Yes, CoreyChem provides custom synthesis services for 5-Methoxycanthin-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.