1-cyclohexyl-3-(5H-purin-6-yl)urea
TL;DR: 1-cyclohexyl-3-(5H-purin-6-yl)urea (CAS 5455-45-8) is a chemical compound with molecular formula C12H16N6O and molecular weight 260.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclohexyl-3-(5H-purin-6-yl)urea
Also Known As: 1-cyclohexyl-3-(5H-purin-6-yl)urea
| Molecular Formula | C12H16N6O |
|---|---|
| Molecular Weight | 260.14 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 90.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 260.13855 |
| Heavy Atoms | 19 |
| Complexity | 486.0 |
Chemical Identifiers
| CAS Number | 5455-45-8 |
|---|---|
| SMILES | C1CCC(CC1)NC(=O)NC2=NC=NC3=NC=NC32 |
| InChIKey | ATHUMABMSPIJGW-UHFFFAOYSA-N |
Product Overview
1-cyclohexyl-3-(5H-purin-6-yl)urea (CAS 5455-45-8), with molecular formula C12H16N6O and molecular weight 260.14 g/mol. IUPAC: 1-cyclohexyl-3-(5H-purin-6-yl)urea.
Chemical Property Profile of 1-cyclohexyl-3-(5H-purin-6-yl)urea
Property Insights of 1-cyclohexyl-3-(5H-purin-6-yl)urea
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-cyclohexyl-3-(5H-purin-6-yl)urea. The TPSA of 90.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-cyclohexyl-3-(5H-purin-6-yl)urea. Following Lipinski's Rule of Five, 1-cyclohexyl-3-(5H-purin-6-yl)urea has 2 hydrogen bond donor(s) and 2 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-cyclohexyl-3-(5H-purin-6-yl)urea?
The CAS number of 1-cyclohexyl-3-(5H-purin-6-yl)urea is 5455-45-8.
What is the molecular formula of 1-cyclohexyl-3-(5H-purin-6-yl)urea?
The molecular formula of 1-cyclohexyl-3-(5H-purin-6-yl)urea is C12H16N6O.
What is the molecular weight of 1-cyclohexyl-3-(5H-purin-6-yl)urea?
The molecular weight of 1-cyclohexyl-3-(5H-purin-6-yl)urea is 260.14 g/mol.
Where can I buy 1-cyclohexyl-3-(5H-purin-6-yl)urea?
You can request a quote for 1-cyclohexyl-3-(5H-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-cyclohexyl-3-(5H-purin-6-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-cyclohexyl-3-(5H-purin-6-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.