1-(2-methylphenyl)-3-(7H-purin-6-yl)urea
TL;DR: 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea (CAS 32725-50-1) is a chemical compound with molecular formula C13H12N6O and molecular weight 268.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methylphenyl)-3-(7H-purin-6-yl)urea
Also Known As: 6-o-Tolylureidopurine, Urea, 1-purin-6-yl-3-o-tolyl-, 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea, Urea, N-(2-methylphenyl)-N'-1H-purin-6-yl-, 1-(2-methylphenyl)-3-(1H-purin-6-yl)urea
| Molecular Formula | C13H12N6O |
|---|---|
| Molecular Weight | 268.11 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 95.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.10727 |
| Heavy Atoms | 20 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 32725-50-1 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)NC2=NC=NC3=C2NC=N3 |
| InChIKey | SBHHSBKWSDKNJU-UHFFFAOYSA-N |
Product Overview
1-(2-methylphenyl)-3-(7H-purin-6-yl)urea (CAS 32725-50-1), with molecular formula C13H12N6O and molecular weight 268.11 g/mol. IUPAC: 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea.
Chemical Property Profile of 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea
Property Insights of 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea. The TPSA of 95.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea. Following Lipinski's Rule of Five, 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea has 3 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 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea?
The CAS number of 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea is 32725-50-1.
What is the molecular formula of 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea?
The molecular formula of 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea is C13H12N6O.
What is the molecular weight of 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea?
The molecular weight of 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea is 268.11 g/mol.
Where can I buy 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea?
You can request a quote for 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-methylphenyl)-3-(7H-purin-6-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.