6-(azepan-1-yl)-9H-purine
TL;DR: 6-(azepan-1-yl)-9H-purine (CAS 537667-01-9) is a chemical compound with molecular formula C11H15N5 and molecular weight 217.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(azepan-1-yl)-7H-purine
Also Known As: 6-(azepan-1-yl)-9H-purine, 6-(azepan-1-yl)-7H-purine, 6-(1-azepanyl)purine, 6-azaperhydroepinylpurine, 6-(1-azepanyl)-7H-purine
| Molecular Formula | C11H15N5 |
|---|---|
| Molecular Weight | 217.13 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 217.13275 |
| Heavy Atoms | 16 |
| Complexity | 226.0 |
Chemical Identifiers
| CAS Number | 537667-01-9 |
|---|---|
| SMILES | C1CCCN(CC1)C2=NC=NC3=C2NC=N3 |
| InChIKey | LPDNHQZTRVRLOW-UHFFFAOYSA-N |
Product Overview
6-(azepan-1-yl)-9H-purine (CAS 537667-01-9), with molecular formula C11H15N5 and molecular weight 217.13 g/mol. IUPAC: 6-(azepan-1-yl)-7H-purine.
Chemical Property Profile of 6-(azepan-1-yl)-9H-purine
Property Insights of 6-(azepan-1-yl)-9H-purine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(azepan-1-yl)-9H-purine. With a topological polar surface area (TPSA) of 57.7 Ų, 6-(azepan-1-yl)-9H-purine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(azepan-1-yl)-9H-purine has 1 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 6-(azepan-1-yl)-9H-purine?
The CAS number of 6-(azepan-1-yl)-9H-purine is 537667-01-9.
What is the molecular formula of 6-(azepan-1-yl)-9H-purine?
The molecular formula of 6-(azepan-1-yl)-9H-purine is C11H15N5.
What is the molecular weight of 6-(azepan-1-yl)-9H-purine?
The molecular weight of 6-(azepan-1-yl)-9H-purine is 217.13 g/mol.
Where can I buy 6-(azepan-1-yl)-9H-purine?
You can request a quote for 6-(azepan-1-yl)-9H-purine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(azepan-1-yl)-9H-purine?
Yes, KEHONG BIO provides custom synthesis services for 6-(azepan-1-yl)-9H-purine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.