9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)-
TL;DR: 9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)- (CAS 56552-70-6) is a chemical compound with molecular formula C24H26N6O and molecular weight 414.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-benzhydrylpiperazin-1-yl)purin-9-yl]ethanol
Also Known As: 9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)-, 2-(4-Diphenylmethyl-1-piperazinyl)-9H-purine-9-ethanol, 5-26-16-00096 (Beilstein Handbook Reference), 2-[2-(4-benzhydrylpiperazin-1-yl)purin-9-yl]ethanol, 2-(4-Diphenylmethyl-piperazinyl)-9-(2-hydroxyethyl)-9H-purine
| Molecular Formula | C24H26N6O |
|---|---|
| Molecular Weight | 414.22 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 70.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 414.2168 |
| Heavy Atoms | 31 |
| Complexity | 526.0 |
Chemical Identifiers
| CAS Number | 56552-70-6 |
|---|---|
| SMILES | C1CN(CCN1C2=NC=C3C(=N2)N(C=N3)CCO)C(C4=CC=CC=C4)C5=CC=CC=C5 |
| InChIKey | FQQCQNGKWMXXDH-UHFFFAOYSA-N |
Product Overview
9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)- (CAS 56552-70-6), with molecular formula C24H26N6O and molecular weight 414.22 g/mol. IUPAC: 2-[2-(4-benzhydrylpiperazin-1-yl)purin-9-yl]ethanol.
Chemical Property Profile of 9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)-
Property Insights of 9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)-. The TPSA of 70.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)-. Following Lipinski's Rule of Five, 9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)- has 1 hydrogen bond donor(s) and 6 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 9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)-?
The CAS number of 9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)- is 56552-70-6.
What is the molecular formula of 9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)-?
The molecular formula of 9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)- is C24H26N6O.
What is the molecular weight of 9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)-?
The molecular weight of 9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)- is 414.22 g/mol.
Where can I buy 9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)-?
You can request a quote for 9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)-?
Yes, KEHONG BIO provides custom synthesis services for 9H-Purine-9-ethanol, 2-(4-benzhydryl-1-piperazinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.