7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione
TL;DR: 7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione (CAS 333768-90-4) is a chemical compound with molecular formula C12H18N4O3S and molecular weight 298.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2-methoxyethyl)-3-methyl-8-propylsulfanylpurine-2,6-dione
Also Known As: BAS 00964878, UPCMLD0ENAT5732065:001, 7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione, 7-(2-methoxyethyl)-3-methyl-8-propylsulfanylpurine-2,6-dione, AB01281170-01
| Molecular Formula | C12H18N4O3S |
|---|---|
| Molecular Weight | 298.11 g/mol |
| LogP | 0.5718 |
| Topological Polar Surface Area | 81.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 298.10995 |
| Heavy Atoms | 20 |
| Complexity | 715.7863 |
Chemical Identifiers
| CAS Number | 333768-90-4 |
|---|---|
| SMILES | CCCSC1=NC2=C(N1CCOC)C(=O)NC(=O)N2C |
Product Overview
7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione (CAS 333768-90-4), with molecular formula C12H18N4O3S and molecular weight 298.11 g/mol. IUPAC: 7-(2-methoxyethyl)-3-methyl-8-propylsulfanylpurine-2,6-dione.
Chemical Property Profile of 7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione
Property Insights of 7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione
The XLogP value of 0.5718 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione. The TPSA of 81.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, 7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione has 1 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-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione?
The CAS number of 7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione is 333768-90-4.
What is the molecular formula of 7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione?
The molecular formula of 7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione is C12H18N4O3S.
What is the molecular weight of 7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione?
The molecular weight of 7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione is 298.11 g/mol.
Where can I buy 7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione?
You can request a quote for 7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-(2-methoxyethyl)-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.