![1-[Bis(azepan-1-yl)phosphoryl]azepane structure](/static/products/2808/28080-46-8.webp)
1-[Bis(azepan-1-yl)phosphoryl]azepane
TL;DR: 1-[Bis(azepan-1-yl)phosphoryl]azepane (CAS 28080-46-8) is a chemical compound with molecular formula C18H36N3OP and molecular weight 341.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[bis(azepan-1-yl)phosphoryl]azepane
Also Known As: m-Toluoyl choline, 3-Toluoyl choline, meta-Toluoyl choline, 1,1',1''-phosphoryltriazepane, 1-[bis(azepan-1-yl)phosphoryl]azepane
| Molecular Formula | C18H36N3OP |
|---|---|
| Molecular Weight | 341.26 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 26.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 341.2596 |
| Heavy Atoms | 23 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 28080-46-8 |
|---|---|
| SMILES | C1CCCN(CC1)P(=O)(N2CCCCCC2)N3CCCCCC3 |
| InChIKey | UIBNUXJFGHZPGR-UHFFFAOYSA-N |
Product Overview
1-[Bis(azepan-1-yl)phosphoryl]azepane (CAS 28080-46-8), with molecular formula C18H36N3OP and molecular weight 341.26 g/mol. IUPAC: 1-[bis(azepan-1-yl)phosphoryl]azepane.
Chemical Property Profile of 1-[Bis(azepan-1-yl)phosphoryl]azepane
Property Insights of 1-[Bis(azepan-1-yl)phosphoryl]azepane
The XLogP value of 3.8 indicates that 1-[Bis(azepan-1-yl)phosphoryl]azepane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.8 Ų, 1-[Bis(azepan-1-yl)phosphoryl]azepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[Bis(azepan-1-yl)phosphoryl]azepane has 0 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 1-[Bis(azepan-1-yl)phosphoryl]azepane?
The CAS number of 1-[Bis(azepan-1-yl)phosphoryl]azepane is 28080-46-8.
What is the molecular formula of 1-[Bis(azepan-1-yl)phosphoryl]azepane?
The molecular formula of 1-[Bis(azepan-1-yl)phosphoryl]azepane is C18H36N3OP.
What is the molecular weight of 1-[Bis(azepan-1-yl)phosphoryl]azepane?
The molecular weight of 1-[Bis(azepan-1-yl)phosphoryl]azepane is 341.26 g/mol.
Where can I buy 1-[Bis(azepan-1-yl)phosphoryl]azepane?
You can request a quote for 1-[Bis(azepan-1-yl)phosphoryl]azepane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[Bis(azepan-1-yl)phosphoryl]azepane?
Yes, KEHONG BIO provides custom synthesis services for 1-[Bis(azepan-1-yl)phosphoryl]azepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.