7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione
TL;DR: 7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione (CAS 329702-65-0) is a chemical compound with molecular formula C20H34N4O3S and molecular weight 410.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione
Also Known As: BAS 00734012, UPCMLD0ENAT5834935:001, AB00988454-01, 7-dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione, 7-dodecyl-8-(2-hydroxyethylthio)-3-methyl-1,3,7-trihydropurine-2,6-dione
| Molecular Formula | C20H34N4O3S |
|---|---|
| Molecular Weight | 410.24 g/mol |
| LogP | 3.4286 |
| Topological Polar Surface Area | 92.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 14 |
| Exact Mass | 410.23517 |
| Heavy Atoms | 28 |
| Complexity | 840.31396 |
Chemical Identifiers
| CAS Number | 329702-65-0 |
|---|---|
| SMILES | CCCCCCCCCCCCN1C2=C(N=C1SCCO)N(C(=O)NC2=O)C |
Product Overview
7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione (CAS 329702-65-0), with molecular formula C20H34N4O3S and molecular weight 410.24 g/mol. IUPAC: 7-dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione.
Chemical Property Profile of 7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione
Property Insights of 7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione
The XLogP value of 3.4286 indicates that 7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione. Following Lipinski's Rule of Five, 7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione has 2 hydrogen bond donor(s) and 5 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 7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione?
The CAS number of 7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione is 329702-65-0.
What is the molecular formula of 7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione?
The molecular formula of 7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione is C20H34N4O3S.
What is the molecular weight of 7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione?
The molecular weight of 7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione is 410.24 g/mol.
Where can I buy 7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione?
You can request a quote for 7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-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 7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-Dodecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.