Augustisine
TL;DR: Augustisine (CAS 125290-49-5) is a chemical compound with molecular formula C18H23NO4 and molecular weight 317.16272 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(10R,12R)-4,6,12-trimethoxy-9-azatetracyclo[7.5.2.01,10.02,7]hexadeca-2,4,6,13-tetraen-5-ol
Also Known As: Augustisine, 3,7,9-Trimethoxy-4,4a-dihydro-3H,6H-5,10b-ethanophenanthridin-8-ol, (3R,4aR)-3,7,9-Trimethoxy-4,4a-dihydro-3H,6H-5,10b-ethanophenanthridin-8-ol
Technical Specifications
| Molecular Formula | C18H23NO4 |
| Molecular Weight | 317.16272 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 51.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 317.16272 Da |
| Heavy Atoms | 23 |
| Complexity | 484.0 |
| SMILES | CO[C@@H]1C[C@@H]2C3(CCN2CC4=C(C(=C(C=C43)OC)O)OC)C=C1 |
| InChIKey | KNPAJXFVTVXASJ-QQDBQQHDSA-N |
Chemical Property Profile of Augustisine
Property Insights of Augustisine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Augustisine. With a topological polar surface area (TPSA) of 51.2 Ų, Augustisine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Augustisine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Augustisine?
The CAS number of Augustisine is 125290-49-5.
What is the molecular formula of Augustisine?
The molecular formula of Augustisine is C18H23NO4.
What is the molecular weight of Augustisine?
The molecular weight of Augustisine is 317.16272 g/mol.
Where can I buy Augustisine?
You can request a quote for Augustisine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Augustisine?
Yes, CoreyChem provides custom synthesis services for Augustisine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.