1-(2,5-Dihydroxybenzylidene)aminoadamantane
TL;DR: 1-(2,5-Dihydroxybenzylidene)aminoadamantane (CAS 112851-89-5) is a chemical compound with molecular formula C17H21NO2 and molecular weight 271.15723 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1-adamantyliminomethyl)benzene-1,4-diol
Also Known As: Oxphaman, Zimet 47-79, ZIMET-47/79, 1-(2,5-Dihydroxybenzylidene)aminoadamantane, 2-(1-adamantyliminomethyl)benzene-1,4-diol
Technical Specifications
| Molecular Formula | C17H21NO2 |
| Molecular Weight | 271.15723 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 52.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 271.15723 Da |
| Heavy Atoms | 20 |
| Complexity | 365.0 |
| SMILES | C1C2CC3CC1CC(C2)(C3)N=CC4=C(C=CC(=C4)O)O |
| InChIKey | KSFHABYHDIUGKU-UHFFFAOYSA-N |
Chemical Property Profile of 1-(2,5-Dihydroxybenzylidene)aminoadamantane
Property Insights of 1-(2,5-Dihydroxybenzylidene)aminoadamantane
The XLogP value of 3.4 indicates that 1-(2,5-Dihydroxybenzylidene)aminoadamantane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.8 Ų, 1-(2,5-Dihydroxybenzylidene)aminoadamantane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,5-Dihydroxybenzylidene)aminoadamantane has 2 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 1-(2,5-Dihydroxybenzylidene)aminoadamantane?
The CAS number of 1-(2,5-Dihydroxybenzylidene)aminoadamantane is 112851-89-5.
What is the molecular formula of 1-(2,5-Dihydroxybenzylidene)aminoadamantane?
The molecular formula of 1-(2,5-Dihydroxybenzylidene)aminoadamantane is C17H21NO2.
What is the molecular weight of 1-(2,5-Dihydroxybenzylidene)aminoadamantane?
The molecular weight of 1-(2,5-Dihydroxybenzylidene)aminoadamantane is 271.15723 g/mol.
Where can I buy 1-(2,5-Dihydroxybenzylidene)aminoadamantane?
You can request a quote for 1-(2,5-Dihydroxybenzylidene)aminoadamantane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2,5-Dihydroxybenzylidene)aminoadamantane?
Yes, CoreyChem provides custom synthesis services for 1-(2,5-Dihydroxybenzylidene)aminoadamantane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.