8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-2,6-dione
TL;DR: 8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-2,6-dione (CAS 331672-28-7) is a chemical compound with molecular formula C18H30N4O3S and molecular weight 382.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(2-hydroxypropylsulfanyl)-3-methyl-7-nonylpurine-2,6-dione
Also Known As: BAS 00396609, 8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-2,6-dione, 8-(2-hydroxypropylsulfanyl)-3-methyl-7-nonylpurine-2,6-dione, 8-((2-hydroxypropyl)thio)-3-methyl-7-nonyl-1H-purine-2,6(3H,7H)-dione, 8-(2-hydroxypropylthio)-3-methyl-7-nonyl-1,3,7-trihydropurine-2,6-dione
| Molecular Formula | C18H30N4O3S |
|---|---|
| Molecular Weight | 382.20 g/mol |
| LogP | 2.6468 |
| Topological Polar Surface Area | 92.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 382.20386 |
| Heavy Atoms | 26 |
| Complexity | 822.17615 |
Chemical Identifiers
| CAS Number | 331672-28-7 |
|---|---|
| SMILES | CCCCCCCCCN1C2=C(N=C1SCC(C)O)N(C(=O)NC2=O)C |
Product Overview
8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-2,6-dione (CAS 331672-28-7), with molecular formula C18H30N4O3S and molecular weight 382.20 g/mol. IUPAC: 8-(2-hydroxypropylsulfanyl)-3-methyl-7-nonylpurine-2,6-dione.
Chemical Property Profile of 8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-2,6-dione
Property Insights of 8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-2,6-dione
The XLogP value of 2.6468 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-2,6-dione. The TPSA of 92.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-2,6-dione. Following Lipinski's Rule of Five, 8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-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 8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-2,6-dione?
The CAS number of 8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-2,6-dione is 331672-28-7.
What is the molecular formula of 8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-2,6-dione?
The molecular formula of 8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-2,6-dione is C18H30N4O3S.
What is the molecular weight of 8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-2,6-dione?
The molecular weight of 8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-2,6-dione is 382.20 g/mol.
Where can I buy 8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-2,6-dione?
You can request a quote for 8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-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 8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 8-(2-Hydroxy-propylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.