8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione
TL;DR: 8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione (CAS 850802-18-5) is a chemical compound with molecular formula C19H23N5O2 and molecular weight 353.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(4-benzylpiperidin-1-yl)-3,7-dimethylpurine-2,6-dione
Also Known As: 8-(4-benzyl-1-piperidyl)-3,7-dimethyl-purine-2,6-dione, 8-(4-benzylpiperidin-1-yl)-3,7-dimethylpurine-2,6-dione, 8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione, 8-(4-benzylpiperidin-1-yl)-6-hydroxy-3,7-dimethyl-3,7-dihydro-2H-purin-2-one
| Molecular Formula | C19H23N5O2 |
|---|---|
| Molecular Weight | 353.19 g/mol |
| LogP | 1.4194 |
| Topological Polar Surface Area | 75.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 353.18518 |
| Heavy Atoms | 26 |
| Complexity | 1039.4622 |
Chemical Identifiers
| CAS Number | 850802-18-5 |
|---|---|
| SMILES | CN1C2=C(N=C1N3CCC(CC3)CC4=CC=CC=C4)N(C(=O)NC2=O)C |
Product Overview
8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione (CAS 850802-18-5), with molecular formula C19H23N5O2 and molecular weight 353.19 g/mol. IUPAC: 8-(4-benzylpiperidin-1-yl)-3,7-dimethylpurine-2,6-dione.
Chemical Property Profile of 8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione
Property Insights of 8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione
The XLogP value of 1.4194 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione. The TPSA of 75.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, 8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione has 1 hydrogen bond donor(s) and 4 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 8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione?
The CAS number of 8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione is 850802-18-5.
What is the molecular formula of 8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione?
The molecular formula of 8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione is C19H23N5O2.
What is the molecular weight of 8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione?
The molecular weight of 8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione is 353.19 g/mol.
Where can I buy 8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione?
You can request a quote for 8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 8-(4-benzylpiperidin-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.