9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one
TL;DR: 9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one (CAS 120336-11-0) is a chemical compound with molecular formula C14H12N2O2 and molecular weight 240.08987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
13-hydroxy-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,9(16),10(15),11,13-pentaen-2-one
Also Known As: Fluorodaturatin, 9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one, 2,3,4,5-Tetrahydro-1H-indolo[3,2,1-de][1,5]naphthyridine-6,9-dione
Technical Specifications
| Molecular Formula | C14H12N2O2 |
| Molecular Weight | 240.08987 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 240.08987 Da |
| Heavy Atoms | 18 |
| Complexity | 420.0 |
| SMILES | C1CC(=O)N2C3=C(C=CC(=C3)O)C4=C2C1=NCC4 |
| InChIKey | BNFIDCOONSTWGB-UHFFFAOYSA-N |
Chemical Property Profile of 9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one
Property Insights of 9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one. With a topological polar surface area (TPSA) of 54.6 Ų, 9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one 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
What is the CAS number of 9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one?
The CAS number of 9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one is 120336-11-0.
What is the molecular formula of 9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one?
The molecular formula of 9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one is C14H12N2O2.
What is the molecular weight of 9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one?
The molecular weight of 9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one is 240.08987 g/mol.
Where can I buy 9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one?
You can request a quote for 9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one?
Yes, CoreyChem provides custom synthesis services for 9-Hydroxy-1,2,4,5-tetrahydro-canthin-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.