N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine
TL;DR: N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine (CAS 54119-68-5) is a chemical compound with molecular formula C22H24Cl2NO3P and molecular weight 451.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine
Also Known As: N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine, N1-(Theophyllinyl-8-)-N4-aethoxycarbonylpiperazin, Bis(2-chlorophenyl) N-(adamantan-1-yl)phosphoramidate
| Molecular Formula | C22H24Cl2NO3P |
|---|---|
| Molecular Weight | 451.09 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 451.0871 |
| Heavy Atoms | 29 |
| Complexity | 578.0 |
Chemical Identifiers
| CAS Number | 54119-68-5 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)NP(=O)(OC4=CC=CC=C4Cl)OC5=CC=CC=C5Cl |
| InChIKey | QJZYPVHGSNKGTG-UHFFFAOYSA-N |
Product Overview
N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine (CAS 54119-68-5), with molecular formula C22H24Cl2NO3P and molecular weight 451.09 g/mol. IUPAC: N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine.
Chemical Property Profile of N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine
Property Insights of N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine
The XLogP value of 6.8 indicates that N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine?
The CAS number of N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine is 54119-68-5.
What is the molecular formula of N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine?
The molecular formula of N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine is C22H24Cl2NO3P.
What is the molecular weight of N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine?
The molecular weight of N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine is 451.09 g/mol.
Where can I buy N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine?
You can request a quote for N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for N-bis(2-chlorophenoxy)phosphoryladamantan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.