6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine
TL;DR: 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine (CAS 4526-64-1) is a chemical compound with molecular formula C13H15N7O2S and molecular weight 333.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine
Also Known As: 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine, 6-(2-ethyl-5-nitro-3-propyl-imidazol-4-yl)sulfanyl-5H-purine, 6-(2-ethyl-5-nitro-3-propyl-imidazol-4-yl)sulfanyl-7H-purine, 1H-Purine, 6-[(2-ethyl-4-nitro-1-propyl-1H-imidazol-5-yl)thio]-, 6-((2-ethyl-4-nitro-1-propyl-1H-imidazol-5-yl)thio)-7H-purine
| Molecular Formula | C13H15N7O2S |
|---|---|
| Molecular Weight | 333.10 g/mol |
| LogP | 2.5812 |
| Topological Polar Surface Area | 115.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 333.1008 |
| Heavy Atoms | 23 |
| Complexity | 857.2504 |
Chemical Identifiers
| CAS Number | 4526-64-1 |
|---|---|
| SMILES | CCCN1C(=NC(=C1SC2=NC=NC3=C2NC=N3)[N+](=O)[O-])CC |
Product Overview
6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine (CAS 4526-64-1), with molecular formula C13H15N7O2S and molecular weight 333.10 g/mol. IUPAC: 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine.
Chemical Property Profile of 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine
Property Insights of 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine
The XLogP value of 2.5812 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine. The TPSA of 115.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine. Following Lipinski's Rule of Five, 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine has 1 hydrogen bond donor(s) and 7 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 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine?
The CAS number of 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine is 4526-64-1.
What is the molecular formula of 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine?
The molecular formula of 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine is C13H15N7O2S.
What is the molecular weight of 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine?
The molecular weight of 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine is 333.10 g/mol.
Where can I buy 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine?
You can request a quote for 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine?
Yes, KEHONG BIO provides custom synthesis services for 6-(2-ethyl-5-nitro-3-propylimidazol-4-yl)sulfanyl-7H-purine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.