O(6)-n-Butylguanine
TL;DR: O(6)-n-Butylguanine (CAS 76412-62-9) is a chemical compound with molecular formula C9H13N5O and molecular weight 207.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-butoxy-7H-purin-2-amine
Also Known As: o6-butylguanine, 6-butoxy-9H-purin-2-amine, O(6)-n-Butylguanine, 6-butoxy-7H-purin-2-amine, O(6)-Butylguanine
| Molecular Formula | C9H13N5O |
|---|---|
| Molecular Weight | 207.11 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 89.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 207.11201 |
| Heavy Atoms | 15 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 76412-62-9 |
|---|---|
| SMILES | CCCCOC1=NC(=NC2=C1NC=N2)N |
| InChIKey | SPHOZXNZJHRHSL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
O(6)-n-Butylguanine (CAS 76412-62-9), with molecular formula C9H13N5O and molecular weight 207.11 g/mol. IUPAC: 6-butoxy-7H-purin-2-amine.
Chemical Property Profile of O(6)-n-Butylguanine
Property Insights of O(6)-n-Butylguanine
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O(6)-n-Butylguanine. The TPSA of 89.7 Ų falls within the moderate polarity range, balancing permeability and solubility for O(6)-n-Butylguanine. Following Lipinski's Rule of Five, O(6)-n-Butylguanine has 2 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 O(6)-n-Butylguanine?
The CAS number of O(6)-n-Butylguanine is 76412-62-9.
What is the molecular formula of O(6)-n-Butylguanine?
The molecular formula of O(6)-n-Butylguanine is C9H13N5O.
What is the molecular weight of O(6)-n-Butylguanine?
The molecular weight of O(6)-n-Butylguanine is 207.11 g/mol.
Where can I buy O(6)-n-Butylguanine?
You can request a quote for O(6)-n-Butylguanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O(6)-n-Butylguanine?
Yes, KEHONG BIO provides custom synthesis services for O(6)-n-Butylguanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.