(S,S)-DACH-pyridyl Trost ligand
TL;DR: (S,S)-DACH-pyridyl Trost ligand (CAS 172138-95-3) is a chemical compound with molecular formula C18H20N4O2 and molecular weight 324.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1S,2S)-2-(pyridine-2-carbonylamino)cyclohexyl]pyridine-2-carboxamide
Also Known As: N,N'-((1S,2S)-Cyclohexane-1,2-diyl)dipicolinamide, (S,S)-DACH-pyridyl Trost ligand, 3,5-bis-methoxybenzoyl chloride, 8849AA, (+)-N,N'-(1S,2S)-1,2-Diaminocyclohexanediylbis(2-pyridinecarboxamide)
| Molecular Formula | C18H20N4O2 |
|---|---|
| Molecular Weight | 324.16 g/mol |
| LogP | 1.9476 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.15863 |
| Heavy Atoms | 24 |
| Complexity | 629.1796 |
Chemical Identifiers
| CAS Number | 172138-95-3 |
|---|---|
| SMILES | C1CC[C@@H]([C@H](C1)NC(=O)C2=CC=CC=N2)NC(=O)C3=CC=CC=N3 |
Product Overview
(S,S)-DACH-pyridyl Trost ligand (CAS 172138-95-3), with molecular formula C18H20N4O2 and molecular weight 324.16 g/mol. IUPAC: N-[(1S,2S)-2-(pyridine-2-carbonylamino)cyclohexyl]pyridine-2-carboxamide.
Chemical Property Profile of (S,S)-DACH-pyridyl Trost ligand
Property Insights of (S,S)-DACH-pyridyl Trost ligand
The XLogP value of 1.9476 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S,S)-DACH-pyridyl Trost ligand. The TPSA of 83.98 Ų falls within the moderate polarity range, balancing permeability and solubility for (S,S)-DACH-pyridyl Trost ligand. Following Lipinski's Rule of Five, (S,S)-DACH-pyridyl Trost ligand has 2 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 (S,S)-DACH-pyridyl Trost ligand?
The CAS number of (S,S)-DACH-pyridyl Trost ligand is 172138-95-3.
What is the molecular formula of (S,S)-DACH-pyridyl Trost ligand?
The molecular formula of (S,S)-DACH-pyridyl Trost ligand is C18H20N4O2.
What is the molecular weight of (S,S)-DACH-pyridyl Trost ligand?
The molecular weight of (S,S)-DACH-pyridyl Trost ligand is 324.16 g/mol.
Where can I buy (S,S)-DACH-pyridyl Trost ligand?
You can request a quote for (S,S)-DACH-pyridyl Trost ligand directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S,S)-DACH-pyridyl Trost ligand?
Yes, KEHONG BIO provides custom synthesis services for (S,S)-DACH-pyridyl Trost ligand and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.