1-cyclohexyl-7H-purin-6-one
TL;DR: 1-cyclohexyl-7H-purin-6-one (CAS 40067-46-7) is a chemical compound with molecular formula C11H14N4O and molecular weight 218.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclohexyl-7H-purin-6-one
Also Known As: 1-cyclohexyl-7H-purin-6-one, 1-Cyclohexyl-1,7-dihydro-6H-purin-6-one
| Molecular Formula | C11H14N4O |
|---|---|
| Molecular Weight | 218.12 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.11676 |
| Heavy Atoms | 16 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 40067-46-7 |
|---|---|
| SMILES | C1CCC(CC1)N2C=NC3=C(C2=O)NC=N3 |
| InChIKey | HSLRGWDEYKALJD-UHFFFAOYSA-N |
Product Overview
1-cyclohexyl-7H-purin-6-one (CAS 40067-46-7), with molecular formula C11H14N4O and molecular weight 218.12 g/mol. IUPAC: 1-cyclohexyl-7H-purin-6-one.
Chemical Property Profile of 1-cyclohexyl-7H-purin-6-one
Property Insights of 1-cyclohexyl-7H-purin-6-one
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-cyclohexyl-7H-purin-6-one. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-cyclohexyl-7H-purin-6-one. Following Lipinski's Rule of Five, 1-cyclohexyl-7H-purin-6-one has 1 hydrogen bond donor(s) and 3 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-7H-purin-6-one?
The CAS number of 1-cyclohexyl-7H-purin-6-one is 40067-46-7.
What is the molecular formula of 1-cyclohexyl-7H-purin-6-one?
The molecular formula of 1-cyclohexyl-7H-purin-6-one is C11H14N4O.
What is the molecular weight of 1-cyclohexyl-7H-purin-6-one?
The molecular weight of 1-cyclohexyl-7H-purin-6-one is 218.12 g/mol.
Where can I buy 1-cyclohexyl-7H-purin-6-one?
You can request a quote for 1-cyclohexyl-7H-purin-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-cyclohexyl-7H-purin-6-one?
Yes, KEHONG BIO provides custom synthesis services for 1-cyclohexyl-7H-purin-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.