![1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane structure](/static/products/409/40913-85-7.png)
1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane
TL;DR: 1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane (CAS 40913-85-7) is a chemical compound with molecular formula C12H19N3 and molecular weight 205.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-pyridin-2-ylethyl)-1,4-diazepane
Also Known As: 1-[2-(pyridin-2-yl)ethyl]-1,4-diazepane, 1-(2-pyridin-2-ylethyl)-1,4-diazepane, 1-(2-(pyridin-2-yl)ethyl)-1,4-diazepane, 1-[2-(2-pyridyl)ethyl]-1,4-diazepane, 1-(2-(2-pyridyl)ethyl)-1,4-diazaperhydroepine
| Molecular Formula | C12H19N3 |
|---|---|
| Molecular Weight | 205.16 g/mol |
| LogP | 0.9194 |
| Topological Polar Surface Area | 28.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 205.1579 |
| Heavy Atoms | 15 |
| Complexity | 265.45554 |
Chemical Identifiers
| CAS Number | 40913-85-7 |
|---|---|
| SMILES | C1CNCCN(C1)CCC2=CC=CC=N2 |
Product Overview
1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane (CAS 40913-85-7), with molecular formula C12H19N3 and molecular weight 205.16 g/mol. IUPAC: 1-(2-pyridin-2-ylethyl)-1,4-diazepane.
Chemical Property Profile of 1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane
Property Insights of 1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane
The XLogP value of 0.9194 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane. With a topological polar surface area (TPSA) of 28.16 Ų, 1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane 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-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane?
The CAS number of 1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane is 40913-85-7.
What is the molecular formula of 1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane?
The molecular formula of 1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane is C12H19N3.
What is the molecular weight of 1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane?
The molecular weight of 1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane is 205.16 g/mol.
Where can I buy 1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane?
You can request a quote for 1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(Pyridin-2-yl)ethyl]-1,4-diazepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.