7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-purine-2,6-dione
TL;DR: 7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-purine-2,6-dione (CAS 476480-27-0) is a chemical compound with molecular formula C17H20N4O3 and molecular weight 328.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-benzyl-1,3-dimethyl-8-propoxypurine-2,6-dione
Also Known As: ASN 05914548, 7-BENZYL-1,3-DIMETHYL-8-PROPOXY-3,7-DIHYDRO-1H-PURINE-2,6-DIONE, 7-benzyl-1,3-dimethyl-8-propoxypurine-2,6-dione, 7-Benzyl-1,3-dimethyl-8-propoxy-1H-purine-2,6(3H,7H)-dione, 7-benzyl-1,3-dimethyl-8-propoxy-2,3,6,7-tetrahydro-1H-purine-2,6-dione
| Molecular Formula | C17H20N4O3 |
|---|---|
| Molecular Weight | 328.15 g/mol |
| LogP | 1.2708 |
| Topological Polar Surface Area | 71.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 328.15353 |
| Heavy Atoms | 24 |
| Complexity | 982.9688 |
Chemical Identifiers
| CAS Number | 476480-27-0 |
|---|---|
| SMILES | CCCOC1=NC2=C(N1CC3=CC=CC=C3)C(=O)N(C(=O)N2C)C |
Product Overview
7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-purine-2,6-dione (CAS 476480-27-0), with molecular formula C17H20N4O3 and molecular weight 328.15 g/mol. IUPAC: 7-benzyl-1,3-dimethyl-8-propoxypurine-2,6-dione.
Chemical Property Profile of 7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-purine-2,6-dione
Property Insights of 7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-purine-2,6-dione
The XLogP value of 1.2708 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-purine-2,6-dione. The TPSA of 71.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-purine-2,6-dione. Following Lipinski's Rule of Five, 7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-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 7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-purine-2,6-dione?
The CAS number of 7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-purine-2,6-dione is 476480-27-0.
What is the molecular formula of 7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-purine-2,6-dione?
The molecular formula of 7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-purine-2,6-dione is C17H20N4O3.
What is the molecular weight of 7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-purine-2,6-dione?
The molecular weight of 7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-purine-2,6-dione is 328.15 g/mol.
Where can I buy 7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-purine-2,6-dione?
You can request a quote for 7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-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 7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-Benzyl-1,3-dimethyl-8-propoxy-3,7-dihydro-1H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.