7-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-dione
TL;DR: 7-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-dione (CAS 578744-92-0) is a chemical compound with molecular formula C22H30N6O2 and molecular weight 410.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-hexyl-3-methyl-8-(4-phenylpiperazin-1-yl)purine-2,6-dione
Also Known As: UPCMLD0ENAT5831695:001, 7-hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-dione, 7-hexyl-3-methyl-8-(4-phenylpiperazin-1-yl)purine-2,6-dione, 7-hexyl-3-methyl-8-(4-phenylpiperazin-1-yl)-1H-purine-2,6(3H,7H)-dione, 7-hexyl-3-methyl-8-(4-phenylpiperazinyl)-1,3,7-trihydropurine-2,6-dione
| Molecular Formula | C22H30N6O2 |
|---|---|
| Molecular Weight | 410.24 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 73.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 410.243 |
| Heavy Atoms | 30 |
| Complexity | 602.0 |
Chemical Identifiers
| CAS Number | 578744-92-0 |
|---|---|
| SMILES | CCCCCCN1C2=C(N=C1N3CCN(CC3)C4=CC=CC=C4)N(C(=O)NC2=O)C |
| InChIKey | JXYZGKDPFLRYBL-UHFFFAOYSA-N |
Product Overview
7-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-dione (CAS 578744-92-0), with molecular formula C22H30N6O2 and molecular weight 410.24 g/mol. IUPAC: 7-hexyl-3-methyl-8-(4-phenylpiperazin-1-yl)purine-2,6-dione.
Chemical Property Profile of 7-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-dione
Property Insights of 7-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-dione
The XLogP value of 3.7 indicates that 7-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-dione. Following Lipinski's Rule of Five, 7-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-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-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-dione?
The CAS number of 7-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-dione is 578744-92-0.
What is the molecular formula of 7-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-dione?
The molecular formula of 7-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-dione is C22H30N6O2.
What is the molecular weight of 7-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-dione?
The molecular weight of 7-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-dione is 410.24 g/mol.
Where can I buy 7-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-dione?
You can request a quote for 7-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)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 7-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-Hexyl-3-methyl-8-(4-phenyl-1-piperazinyl)purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.