![8-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione structure](/static/products/299/299419-50-4.png)
8-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione
TL;DR: 8-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione (CAS 299419-50-4) is a chemical compound with molecular formula C13H13N5O3 and molecular weight 287.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(4-methoxyanilino)-3-methyl-7H-purine-2,6-dione
Also Known As: BAS 00162620, 8-(4-methoxyanilino)-3-methyl-7H-purine-2,6-dione, 8-((4-methoxyphenyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione, 8-(4-Methoxy-phenylamino)-3-methyl-3,7-dihydro-purine-2,6-dione, 8-[(4-methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione
| Molecular Formula | C13H13N5O3 |
|---|---|
| Molecular Weight | 287.10 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 99.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.10184 |
| Heavy Atoms | 21 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 299419-50-4 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)NC(=N2)NC3=CC=C(C=C3)OC |
| InChIKey | ZOIJTHOTSFXROS-UHFFFAOYSA-N |
Product Overview
8-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione (CAS 299419-50-4), with molecular formula C13H13N5O3 and molecular weight 287.10 g/mol. IUPAC: 8-(4-methoxyanilino)-3-methyl-7H-purine-2,6-dione.
Chemical Property Profile of 8-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione
Property Insights of 8-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione. The TPSA of 99.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione. Following Lipinski's Rule of Five, 8-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione has 3 hydrogen bond donor(s) and 5 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-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione?
The CAS number of 8-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione is 299419-50-4.
What is the molecular formula of 8-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione?
The molecular formula of 8-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione is C13H13N5O3.
What is the molecular weight of 8-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione?
The molecular weight of 8-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione is 287.10 g/mol.
Where can I buy 8-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione?
You can request a quote for 8-[(4-Methoxyphenyl)amino]-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-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 8-[(4-Methoxyphenyl)amino]-3-methyl-1,3,7-trihydropurine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.