(2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid
TL;DR: (2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid (CAS 121825-93-2) is a chemical compound with molecular formula C12H11Cl3N2O6 and molecular weight 383.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[2-[(3,5,6-trichloro-2-pyridinyl)oxy]acetyl]amino]pentanedioic acid
Also Known As: (2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid, (2S)-2-[[2-(3,5,6-trichloropyridin-2-yl)oxyacetyl]amino]pentanedioic Acid, N-{[(3,5,6-Trichloropyridin-2-yl)oxy]acetyl}-L-glutamic acid
| Molecular Formula | C12H11Cl3N2O6 |
|---|---|
| Molecular Weight | 383.97 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 383.96826 |
| Heavy Atoms | 23 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 121825-93-2 |
|---|---|
| SMILES | C1=C(C(=NC(=C1Cl)Cl)OCC(=O)N[C@@H](CCC(=O)O)C(=O)O)Cl |
| InChIKey | BBBCOLFELMEDMD-ZETCQYMHSA-N |
Product Overview
(2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid (CAS 121825-93-2), with molecular formula C12H11Cl3N2O6 and molecular weight 383.97 g/mol. IUPAC: (2S)-2-[[2-[(3,5,6-trichloro-2-pyridinyl)oxy]acetyl]amino]pentanedioic acid.
Chemical Property Profile of (2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid
Property Insights of (2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid. Following Lipinski's Rule of Five, (2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid has 3 hydrogen bond donor(s) and 7 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 (2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid?
The CAS number of (2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid is 121825-93-2.
What is the molecular formula of (2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid?
The molecular formula of (2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid is C12H11Cl3N2O6.
What is the molecular weight of (2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid?
The molecular weight of (2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid is 383.97 g/mol.
Where can I buy (2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid?
You can request a quote for (2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-((2-(3,5,6-Trichloropyridin-2-yl)oxyacetyl)amino)pentanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.