1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)-
TL;DR: 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)- (CAS 110480-52-9) is a chemical compound with molecular formula C29H36N6O3 and molecular weight 516.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[2-(4-benzhydrylpiperazin-1-yl)-1-hydroxyethyl]-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione
Also Known As: 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)-, 8-[2-(4-benzhydrylpiperazin-1-yl)-1-hydroxyethyl]-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione, 8-{2-[4-(Diphenylmethyl)piperazin-1-yl]-1-hydroxyethyl}-1-methyl-3-(2-methylpropyl)-3,9-dihydro-1H-purine-2,6-dione, BRN 5684649, RefChem:239646
| Molecular Formula | C29H36N6O3 |
|---|---|
| Molecular Weight | 516.28 g/mol |
| LogP | 2.5199 |
| Topological Polar Surface Area | 99.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 516.2849 |
| Heavy Atoms | 38 |
| Complexity | 1444.5245 |
Chemical Identifiers
| CAS Number | 110480-52-9 |
|---|---|
| SMILES | CC(C)CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C(CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O |
Product Overview
1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)- (CAS 110480-52-9), with molecular formula C29H36N6O3 and molecular weight 516.28 g/mol. IUPAC: 8-[2-(4-benzhydrylpiperazin-1-yl)-1-hydroxyethyl]-1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione.
Chemical Property Profile of 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)-
Property Insights of 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)-
The XLogP value of 2.5199 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)-. The TPSA of 99.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)-. Following Lipinski's Rule of Five, 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)- has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)-?
The CAS number of 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)- is 110480-52-9.
What is the molecular formula of 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)-?
The molecular formula of 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)- is C29H36N6O3.
What is the molecular weight of 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)-?
The molecular weight of 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)- is 516.28 g/mol.
Where can I buy 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)-?
You can request a quote for 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(diphenylmethyl)-1-piperazinyl)-1-hydroxyethyl)-1-methyl-3-(2-methylpropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.