Trost Ligand
TL;DR: Trost Ligand (CAS 169689-05-8) is a chemical compound with molecular formula C44H40N2O2P2 and molecular weight 690.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-diphenylphosphanyl-N-[(1R,2R)-2-[(2-diphenylphosphanylbenzoyl)amino]cyclohexyl]benzamide
Also Known As: Trost ligand, (R)-Trost ligand, (R,R)-DACH-phenyl Trost ligand, (R,R)-Trost ligand, (R,R)-Dppba
| Molecular Formula | C44H40N2O2P2 |
|---|---|
| Molecular Weight | 690.26 g/mol |
| LogP | 6.674 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 690.25653 |
| Heavy Atoms | 50 |
| Complexity | 1796.4305 |
Chemical Identifiers
| CAS Number | 169689-05-8 |
|---|---|
| SMILES | C1CC[C@H]([C@@H](C1)NC(=O)C2=CC=CC=C2P(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C5=CC=CC=C5P(C6=CC=CC=C6)C7=CC=CC=C7 |
Product Overview
Trost Ligand (CAS 169689-05-8), with molecular formula C44H40N2O2P2 and molecular weight 690.26 g/mol. IUPAC: 2-diphenylphosphanyl-N-[(1R,2R)-2-[(2-diphenylphosphanylbenzoyl)amino]cyclohexyl]benzamide.
Chemical Property Profile of Trost Ligand
Property Insights of Trost Ligand
The XLogP value of 6.674 indicates that Trost Ligand is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, Trost Ligand exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trost Ligand has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Trost Ligand?
The CAS number of Trost Ligand is 169689-05-8.
What is the molecular formula of Trost Ligand?
The molecular formula of Trost Ligand is C44H40N2O2P2.
What is the molecular weight of Trost Ligand?
The molecular weight of Trost Ligand is 690.26 g/mol.
Where can I buy Trost Ligand?
You can request a quote for Trost Ligand directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trost Ligand?
Yes, KEHONG BIO provides custom synthesis services for Trost Ligand and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.