6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine
TL;DR: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine (CAS 24926-49-6) is a chemical compound with molecular formula C17H18N6O2 and molecular weight 338.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine
Also Known As: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine, 6-(4-piperonylpiperazino)-7H-purine, 6-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-9H-purine, 6-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-7H-purine, 6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]-1-piperazinyl}purine
| Molecular Formula | C17H18N6O2 |
|---|---|
| Molecular Weight | 338.15 g/mol |
| LogP | 1.4038 |
| Topological Polar Surface Area | 79.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.1491 |
| Heavy Atoms | 25 |
| Complexity | 903.0444 |
Chemical Identifiers
| CAS Number | 24926-49-6 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=NC=NC5=C4NC=N5 |
Product Overview
6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine (CAS 24926-49-6), with molecular formula C17H18N6O2 and molecular weight 338.15 g/mol. IUPAC: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine.
Chemical Property Profile of 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine
Property Insights of 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine
The XLogP value of 1.4038 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine. The TPSA of 79.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine. Following Lipinski's Rule of Five, 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-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-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine?
The CAS number of 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine is 24926-49-6.
What is the molecular formula of 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine?
The molecular formula of 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine is C17H18N6O2.
What is the molecular weight of 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine?
The molecular weight of 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine is 338.15 g/mol.
Where can I buy 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine?
You can request a quote for 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-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-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine?
Yes, KEHONG BIO provides custom synthesis services for 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7H-purine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.