1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine
TL;DR: 1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine (CAS 149741-43-5) is a chemical compound with molecular formula C25H31N5O2 and molecular weight 433.24777 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-(4-aminophenyl)ethyl]-3-propyl-8-(3-tricyclo[3.3.1.03,7]nonanyl)-7H-purine-2,6-dione
Also Known As: 1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine, 1H-Purine-2,6-dione, 3,7-dihydro-1-(2-(4-aminophenyl)ethyl)-8-(hexahydro-2,5-methanopentalen-3a(1H)-yl)-3-propyl-, 1-[2-(4-Aminophenyl)ethyl]-8-(hexahydro-2,5-methanopentalen-3a(1H)-yl)-3-propyl-3,9-dihydro-1H-purine-2,6-dione
Technical Specifications
| Molecular Formula | C25H31N5O2 |
| Molecular Weight | 433.24777 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 95.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 433.24777 Da |
| Heavy Atoms | 32 |
| Complexity | 751.0 |
| SMILES | CCCN1C2=C(C(=O)N(C1=O)CCC3=CC=C(C=C3)N)NC(=N2)C45CC6CC(C4)CC5C6 |
| InChIKey | LLGYAEHPYWPLEC-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine
Property Insights of 1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine
The XLogP value of 5.6 indicates that 1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine. Following Lipinski's Rule of Five, 1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine?
The CAS number of 1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine is 149741-43-5.
What is the molecular formula of 1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine?
The molecular formula of 1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine is C25H31N5O2.
What is the molecular weight of 1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine?
The molecular weight of 1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine is 433.24777 g/mol.
Where can I buy 1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine?
You can request a quote for 1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine?
Yes, CoreyChem provides custom synthesis services for 1-(4-Aminophenethyl)-8-(3-noradamantyl)-3-propylxanthine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.