8-(2-Norbornyl)theophylline
TL;DR: 8-(2-Norbornyl)theophylline (CAS 73908-82-4) is a chemical compound with molecular formula C14H18N4O2 and molecular weight 274.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(2-bicyclo[2.2.1]heptanyl)-1,3-dimethyl-7H-purine-2,6-dione
Also Known As: 8-(2-Norbornyl)theophylline, Theophylline, 8-(2-norbornyl)-, 8-(2-Norbornyl)theophyline, NCIOpen2_006959, 1H-Purine-2,6-dione, 8-bicyclo(2.2.1)hept-2-yl-3,7-dihydro-1,3-dimethyl-
| Molecular Formula | C14H18N4O2 |
|---|---|
| Molecular Weight | 274.14 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 69.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 274.14297 |
| Heavy Atoms | 20 |
| Complexity | 468.0 |
Chemical Identifiers
| CAS Number | 73908-82-4 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3CC4CCC3C4 |
| InChIKey | UZJCKVSZSVKARK-UHFFFAOYSA-N |
Product Overview
8-(2-Norbornyl)theophylline (CAS 73908-82-4), with molecular formula C14H18N4O2 and molecular weight 274.14 g/mol. IUPAC: 8-(2-bicyclo[2.2.1]heptanyl)-1,3-dimethyl-7H-purine-2,6-dione.
Chemical Property Profile of 8-(2-Norbornyl)theophylline
Property Insights of 8-(2-Norbornyl)theophylline
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-(2-Norbornyl)theophylline. The TPSA of 69.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(2-Norbornyl)theophylline. Following Lipinski's Rule of Five, 8-(2-Norbornyl)theophylline 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
Frequently Asked Questions
What is the CAS number of 8-(2-Norbornyl)theophylline?
The CAS number of 8-(2-Norbornyl)theophylline is 73908-82-4.
What is the molecular formula of 8-(2-Norbornyl)theophylline?
The molecular formula of 8-(2-Norbornyl)theophylline is C14H18N4O2.
What is the molecular weight of 8-(2-Norbornyl)theophylline?
The molecular weight of 8-(2-Norbornyl)theophylline is 274.14 g/mol.
Where can I buy 8-(2-Norbornyl)theophylline?
You can request a quote for 8-(2-Norbornyl)theophylline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(2-Norbornyl)theophylline?
Yes, KEHONG BIO provides custom synthesis services for 8-(2-Norbornyl)theophylline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.