2,9-Diethyl-6-(propylsulfanyl)-9h-purine
TL;DR: 2,9-Diethyl-6-(propylsulfanyl)-9h-purine (CAS 6703-19-1) is a chemical compound with molecular formula C12H18N4S and molecular weight 250.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,9-diethyl-6-propylsulfanylpurine
Also Known As: 2,9-diethyl-6-(propylsulfanyl)-9h-purine, 2,9-diethyl-6-propylsulfanylpurine, 2,9-Diethyl-6-(propylthio)-9H-purine, 2,9-diethyl-6-propylsulfanyl-9H-purine, 2,9-Dichloroquino(2,3-b)acridine-6,7,13,14(5H,12H)-tetrone
| Molecular Formula | C12H18N4S |
|---|---|
| Molecular Weight | 250.13 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 68.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 250.12521 |
| Heavy Atoms | 17 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 6703-19-1 |
|---|---|
| SMILES | CCCSC1=NC(=NC2=C1N=CN2CC)CC |
| InChIKey | BWCCECZSAPNBFJ-UHFFFAOYSA-N |
Product Overview
2,9-Diethyl-6-(propylsulfanyl)-9h-purine (CAS 6703-19-1), with molecular formula C12H18N4S and molecular weight 250.13 g/mol. IUPAC: 2,9-diethyl-6-propylsulfanylpurine.
Chemical Property Profile of 2,9-Diethyl-6-(propylsulfanyl)-9h-purine
Property Insights of 2,9-Diethyl-6-(propylsulfanyl)-9h-purine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,9-Diethyl-6-(propylsulfanyl)-9h-purine. The TPSA of 68.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,9-Diethyl-6-(propylsulfanyl)-9h-purine. Following Lipinski's Rule of Five, 2,9-Diethyl-6-(propylsulfanyl)-9h-purine 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 2,9-Diethyl-6-(propylsulfanyl)-9h-purine?
The CAS number of 2,9-Diethyl-6-(propylsulfanyl)-9h-purine is 6703-19-1.
What is the molecular formula of 2,9-Diethyl-6-(propylsulfanyl)-9h-purine?
The molecular formula of 2,9-Diethyl-6-(propylsulfanyl)-9h-purine is C12H18N4S.
What is the molecular weight of 2,9-Diethyl-6-(propylsulfanyl)-9h-purine?
The molecular weight of 2,9-Diethyl-6-(propylsulfanyl)-9h-purine is 250.13 g/mol.
Where can I buy 2,9-Diethyl-6-(propylsulfanyl)-9h-purine?
You can request a quote for 2,9-Diethyl-6-(propylsulfanyl)-9h-purine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,9-Diethyl-6-(propylsulfanyl)-9h-purine?
Yes, KEHONG BIO provides custom synthesis services for 2,9-Diethyl-6-(propylsulfanyl)-9h-purine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.