![7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione structure](/static/products/303/303972-94-3.png)
7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione
TL;DR: 7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione (CAS 303972-94-3) is a chemical compound with molecular formula C21H21N5O2 and molecular weight 375.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-benzyl-3-methyl-8-[(4-methylphenyl)methylamino]purine-2,6-dione
Also Known As: 7-benzyl-3-methyl-8-[(4-methylphenyl)methylamino]purine-2,6-dione, 7-benzyl-3-methyl-8-((4-methylbenzyl)amino)-1H-purine-2,6(3H,7H)-dione, 7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C21H21N5O2 |
|---|---|
| Molecular Weight | 375.17 g/mol |
| LogP | 2.39212 |
| Topological Polar Surface Area | 84.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 375.16953 |
| Heavy Atoms | 28 |
| Complexity | 1234.2628 |
Chemical Identifiers
| CAS Number | 303972-94-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CNC2=NC3=C(N2CC4=CC=CC=C4)C(=O)NC(=O)N3C |
Product Overview
7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione (CAS 303972-94-3), with molecular formula C21H21N5O2 and molecular weight 375.17 g/mol. IUPAC: 7-benzyl-3-methyl-8-[(4-methylphenyl)methylamino]purine-2,6-dione.
Chemical Property Profile of 7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Property Insights of 7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione
The XLogP value of 2.39212 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione. The TPSA of 84.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione. Following Lipinski's Rule of Five, 7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-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 7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione?
The CAS number of 7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione is 303972-94-3.
What is the molecular formula of 7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione?
The molecular formula of 7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione is C21H21N5O2.
What is the molecular weight of 7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione?
The molecular weight of 7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione is 375.17 g/mol.
Where can I buy 7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione?
You can request a quote for 7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-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-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-benzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.