4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine
TL;DR: 4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine (CAS 13022-80-5) is a chemical compound with molecular formula C11H15N3 and molecular weight 189.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-pyridin-4-yl-1,5-diazabicyclo[3.2.1]octane
Also Known As: NCIStruc1_000059, NCIStruc2_000047, 1, 8-(4-pyridyl)-, 8-pyridin-4-yl-1,5-diazabicyclo[3.2.1]octane, 1,5-Diazabicyclo(3.2.1)octane, 8-(4-pyridyl)-
| Molecular Formula | C11H15N3 |
|---|---|
| Molecular Weight | 189.13 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 19.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.1266 |
| Heavy Atoms | 14 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 13022-80-5 |
|---|---|
| SMILES | C1CN2CCN(C1)C2C3=CC=NC=C3 |
| InChIKey | JIKHJTHQLORZIX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine (CAS 13022-80-5), with molecular formula C11H15N3 and molecular weight 189.13 g/mol. IUPAC: 8-pyridin-4-yl-1,5-diazabicyclo[3.2.1]octane.
Chemical Property Profile of 4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine
Property Insights of 4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine. With a topological polar surface area (TPSA) of 19.4 Ų, 4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine has 0 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 4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine?
The CAS number of 4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine is 13022-80-5.
What is the molecular formula of 4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine?
The molecular formula of 4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine is C11H15N3.
What is the molecular weight of 4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine?
The molecular weight of 4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine is 189.13 g/mol.
Where can I buy 4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine?
You can request a quote for 4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,5-Diazabicyclo(3.2.1)oct-8-YL)-pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.