Bipolaroxin
TL;DR: Bipolaroxin (CAS 100665-30-3) is a chemical compound with molecular formula C15H18O4 and molecular weight 262.1205 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(2R,7S,8R,8aR)-2,7-dihydroxy-8,8a-dimethyl-3-oxo-7,8-dihydro-1H-naphthalen-2-yl]prop-2-enal
Also Known As: Bipolaroxin, Dihydrobipolaroxin, HY-N12651, 2-[(2R,7S,8R,8aR)-2,7-dihydroxy-8,8a-dimethyl-3-oxo-7,8-dihydro-1H-naphthalen-2-yl]prop-2-enal, 2-Naphthaleneacetaldehyde, 1,2,3,7,8,8a-hexahydro-2,7-dihydroxy-8,8a-dimethyl-alpha-methylene-3-oxo-, (2R-(2alpha,7alpha,8alpha,8aalpha))-
Technical Specifications
| Molecular Formula | C15H18O4 |
| Molecular Weight | 262.1205 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.1205 Da |
| Heavy Atoms | 19 |
| Complexity | 516.0 |
| SMILES | C[C@H]1[C@H](C=CC2=CC(=O)[C@@](C[C@]12C)(C(=C)C=O)O)O |
| InChIKey | JHFQQYIKTDAADV-OBCWZRDOSA-N |
Chemical Property Profile of Bipolaroxin
Property Insights of Bipolaroxin
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bipolaroxin. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Bipolaroxin. Following Lipinski's Rule of Five, Bipolaroxin has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Bipolaroxin?
The CAS number of Bipolaroxin is 100665-30-3.
What is the molecular formula of Bipolaroxin?
The molecular formula of Bipolaroxin is C15H18O4.
What is the molecular weight of Bipolaroxin?
The molecular weight of Bipolaroxin is 262.1205 g/mol.
Where can I buy Bipolaroxin?
You can request a quote for Bipolaroxin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bipolaroxin?
Yes, CoreyChem provides custom synthesis services for Bipolaroxin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.