3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
TL;DR: 3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione (CAS 838816-96-9) is a chemical compound with molecular formula C15H16N4O3 and molecular weight 300.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-8-(2-propoxyphenyl)-7H-purine-2,6-dione
Also Known As: 3-methyl-8-(2-propoxyphenyl)-7H-purine-2,6-dione, 3-methyl-8-(2-propoxyphenyl)-1H-purine-2,6(3H,7H)-dione, 3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione, 6-hydroxy-3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-2H-purin-2-one
| Molecular Formula | C15H16N4O3 |
|---|---|
| Molecular Weight | 300.12 g/mol |
| LogP | 1.4057 |
| Topological Polar Surface Area | 92.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.12225 |
| Heavy Atoms | 22 |
| Complexity | 935.84595 |
Chemical Identifiers
| CAS Number | 838816-96-9 |
|---|---|
| SMILES | CCCOC1=CC=CC=C1C2=NC3=C(N2)C(=O)NC(=O)N3C |
Product Overview
3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione (CAS 838816-96-9), with molecular formula C15H16N4O3 and molecular weight 300.12 g/mol. IUPAC: 3-methyl-8-(2-propoxyphenyl)-7H-purine-2,6-dione.
Chemical Property Profile of 3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
Property Insights of 3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
The XLogP value of 1.4057 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione. The TPSA of 92.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione. Following Lipinski's Rule of Five, 3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-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 3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione?
The CAS number of 3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione is 838816-96-9.
What is the molecular formula of 3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione?
The molecular formula of 3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione is C15H16N4O3.
What is the molecular weight of 3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione?
The molecular weight of 3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione is 300.12 g/mol.
Where can I buy 3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione?
You can request a quote for 3-methyl-8-(2-propoxyphenyl)-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 3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-8-(2-propoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.