![8-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione structure](/static/products/868/868143-58-2.png)
8-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione
TL;DR: 8-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione (CAS 868143-58-2) is a chemical compound with molecular formula C9H13N5O2 and molecular weight 223.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(dimethylamino)methyl]-3-methyl-7H-purine-2,6-dione
Also Known As: BAS 09869160, SDCCGMLS-0065631.P001, 8-[(dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione, 8-((dimethylamino)methyl)-3-methyl-1H-purine-2,6(3H,7H)-dione, 8-(dimethylaminomethyl)-3-methyl-7H-purine-2,6-dione
| Molecular Formula | C9H13N5O2 |
|---|---|
| Molecular Weight | 223.11 g/mol |
| LogP | -0.9885 |
| Topological Polar Surface Area | 86.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.10692 |
| Heavy Atoms | 16 |
| Complexity | 633.36725 |
Chemical Identifiers
| CAS Number | 868143-58-2 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)NC(=N2)CN(C)C |
Product Overview
8-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione (CAS 868143-58-2), with molecular formula C9H13N5O2 and molecular weight 223.11 g/mol. IUPAC: 8-[(dimethylamino)methyl]-3-methyl-7H-purine-2,6-dione.
Chemical Property Profile of 8-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione
Property Insights of 8-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione
The XLogP value of -0.9885 indicates that 8-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione. Following Lipinski's Rule of Five, 8-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione has 2 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-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione?
The CAS number of 8-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione is 868143-58-2.
What is the molecular formula of 8-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione?
The molecular formula of 8-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione is C9H13N5O2.
What is the molecular weight of 8-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione?
The molecular weight of 8-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione is 223.11 g/mol.
Where can I buy 8-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione?
You can request a quote for 8-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-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-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 8-[(Dimethylamino)methyl]-3-methyl-1,3,7-trihydropurine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.