3-methyl-7-phenethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione
TL;DR: 3-methyl-7-phenethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione (CAS 313230-33-0) 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.
3-methyl-7-(2-phenylethyl)-8-piperidin-1-ylpurine-2,6-dione
Also Known As: BAS 00363920, 3-methyl-7-(2-phenylethyl)-8-piperidin-1-ylpurine-2,6-dione, 3-methyl-7-phenethyl-8-piperidin-1-ylpurine-2,6-dione, F0017-1854, 3-methyl-7-phenethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione
| Molecular Formula | C19H23N5O2 |
|---|---|
| Molecular Weight | 353.19 g/mol |
| LogP | 1.6563 |
| Topological Polar Surface Area | 75.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 353.18518 |
| Heavy Atoms | 26 |
| Complexity | 1025.7495 |
Chemical Identifiers
| CAS Number | 313230-33-0 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCCCC3)CCC4=CC=CC=C4 |
Product Overview
3-methyl-7-phenethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione (CAS 313230-33-0), with molecular formula C19H23N5O2 and molecular weight 353.19 g/mol. IUPAC: 3-methyl-7-(2-phenylethyl)-8-piperidin-1-ylpurine-2,6-dione.
Chemical Property Profile of 3-methyl-7-phenethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione
Property Insights of 3-methyl-7-phenethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione
The XLogP value of 1.6563 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-7-phenethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione. The TPSA of 75.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-7-phenethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, 3-methyl-7-phenethyl-8-(piperidin-1-yl)-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 3-methyl-7-phenethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione?
The CAS number of 3-methyl-7-phenethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione is 313230-33-0.
What is the molecular formula of 3-methyl-7-phenethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione?
The molecular formula of 3-methyl-7-phenethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione is C19H23N5O2.
What is the molecular weight of 3-methyl-7-phenethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione?
The molecular weight of 3-methyl-7-phenethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione is 353.19 g/mol.
Where can I buy 3-methyl-7-phenethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione?
You can request a quote for 3-methyl-7-phenethyl-8-(piperidin-1-yl)-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 3-methyl-7-phenethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-7-phenethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.