8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione
TL;DR: 8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione (CAS 797020-79-2) is a chemical compound with molecular formula C15H22BrN5O2 and molecular weight 383.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-bromo-1,3-dimethyl-7-[2-(4-methylpiperidin-1-yl)ethyl]purine-2,6-dione
Also Known As: 8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione, 8-bromo-1,3-dimethyl-7-[2-(4-methylpiperidin-1-yl)ethyl]purine-2,6-dione, 8-bromo-1,3-dimethyl-7-(2-(4-methylpiperidin-1-yl)ethyl)-1H-purine-2,6(3H,7H)-dione, 8-bromo-1,3-dimethyl-7-[2-(4-methylpiperidin-1-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C15H22BrN5O2 |
|---|---|
| Molecular Weight | 383.10 g/mol |
| LogP | 0.9281 |
| Topological Polar Surface Area | 65.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 383.0957 |
| Heavy Atoms | 23 |
| Complexity | 842.14 |
Chemical Identifiers
| CAS Number | 797020-79-2 |
|---|---|
| SMILES | CC1CCN(CC1)CCN2C3=C(N=C2Br)N(C(=O)N(C3=O)C)C |
Product Overview
8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione (CAS 797020-79-2), with molecular formula C15H22BrN5O2 and molecular weight 383.10 g/mol. IUPAC: 8-bromo-1,3-dimethyl-7-[2-(4-methylpiperidin-1-yl)ethyl]purine-2,6-dione.
Chemical Property Profile of 8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione
Property Insights of 8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione
The XLogP value of 0.9281 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione. The TPSA of 65.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione. Following Lipinski's Rule of Five, 8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione has 0 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-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione?
The CAS number of 8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione is 797020-79-2.
What is the molecular formula of 8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione?
The molecular formula of 8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione is C15H22BrN5O2.
What is the molecular weight of 8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione?
The molecular weight of 8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione is 383.10 g/mol.
Where can I buy 8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione?
You can request a quote for 8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 8-bromo-1,3-dimethyl-7-[2-(4-methyl-1-piperidyl)ethyl]purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.