1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione
TL;DR: 1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione (CAS 73747-37-2) is a chemical compound with molecular formula C15H22N4O3 and molecular weight 306.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,7-trimethyl-8-(4-methylcyclohexyl)oxypurine-2,6-dione
Also Known As: iodo-3 octanone-2, 8-((cis-4-Methylcyclohexyl)oxy)caffeine, 8-[(cis-4-Methylcyclohexyl)oxy]caffeine, 8-[trans-4-Methylcyclohexyloxy]carffeine, CAFFEINE, 8-((cis-4-METHYLCYCLOHEXYL)OXY)-
| Molecular Formula | C15H22N4O3 |
|---|---|
| Molecular Weight | 306.17 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 67.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 306.1692 |
| Heavy Atoms | 22 |
| Complexity | 464.0 |
Chemical Identifiers
| CAS Number | 73747-37-2 |
|---|---|
| SMILES | CC1CCC(CC1)OC2=NC3=C(N2C)C(=O)N(C(=O)N3C)C |
| InChIKey | CTXYKWGQHYADKR-UHFFFAOYSA-N |
Product Overview
1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione (CAS 73747-37-2), with molecular formula C15H22N4O3 and molecular weight 306.17 g/mol. IUPAC: 1,3,7-trimethyl-8-(4-methylcyclohexyl)oxypurine-2,6-dione.
Chemical Property Profile of 1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione
Property Insights of 1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione. The TPSA of 67.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione. Following Lipinski's Rule of Five, 1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione has 0 hydrogen bond donor(s) and 4 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 1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione?
The CAS number of 1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione is 73747-37-2.
What is the molecular formula of 1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione?
The molecular formula of 1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione is C15H22N4O3.
What is the molecular weight of 1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione?
The molecular weight of 1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione is 306.17 g/mol.
Where can I buy 1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione?
You can request a quote for 1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,3,7-Trimethyl-8-((4-methylcyclohexyl)oxy)-3,7-dihydro-1H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.