9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine
TL;DR: 9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine (CAS 47806-67-7) is a chemical compound with molecular formula C33H34N6 and molecular weight 514.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-prop-2-enyl-2-[4-(3,3,3-triphenylpropyl)piperazin-1-yl]purine
Also Known As: 9-prop-2-enyl-2-[4-(3,3,3-triphenylpropyl)piperazin-1-yl]purine, 9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine, 9-(prop-2-en-1-yl)-2-[4-(3,3,3-triphenylpropyl)piperazin-1-yl]-9H-purine
| Molecular Formula | C33H34N6 |
|---|---|
| Molecular Weight | 514.28 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 50.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 514.2845 |
| Heavy Atoms | 39 |
| Complexity | 702.0 |
Chemical Identifiers
| CAS Number | 47806-67-7 |
|---|---|
| SMILES | C=CCN1C=NC2=CN=C(N=C21)N3CCN(CC3)CCC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6 |
| InChIKey | AQKVOQJZEPBFKV-UHFFFAOYSA-N |
Product Overview
9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine (CAS 47806-67-7), with molecular formula C33H34N6 and molecular weight 514.28 g/mol. IUPAC: 9-prop-2-enyl-2-[4-(3,3,3-triphenylpropyl)piperazin-1-yl]purine.
Chemical Property Profile of 9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine
Property Insights of 9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine
The XLogP value of 6.5 indicates that 9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.1 Ų, 9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine?
The CAS number of 9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine is 47806-67-7.
What is the molecular formula of 9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine?
The molecular formula of 9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine is C33H34N6.
What is the molecular weight of 9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine?
The molecular weight of 9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine is 514.28 g/mol.
Where can I buy 9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine?
You can request a quote for 9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine?
Yes, KEHONG BIO provides custom synthesis services for 9-Allyl-2-(4-(3,3,3-triphenylpropyl)piperazin-1-yl)-9H-purine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.