N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid
TL;DR: N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid (CAS 337511-96-3) is a chemical compound with molecular formula C27H30N6O4 and molecular weight 502.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(2-carboxy-4-pyridin-2-ylpiperazin-1-yl)-4-methylphenyl]-4-pyridin-2-ylpiperazine-2-carboxylic acid
Also Known As: N,N-(2,4-TOLUENE)BIS-4-(2-PYRIDINYL)-2-PIPERAZINECARBOXYLIC ACID, 1-[3-(2-carboxy-4-pyridin-2-ylpiperazin-1-yl)-4-methylphenyl]-4-pyridin-2-ylpiperazine-2-carboxylic acid, N,N-(2,4-TOLUENE)BIS-4-(2-PYRIDINYL)-2-PIPERAZINECARBOXYLICACID, 1-[3-[2-carboxy-4-(2-pyridyl)piperazin-1-yl]-4-methyl-phenyl]-4-(2-pyridyl)piperazine-2-carboxylic acid, 1-[5-(2-carboxy-4-(2-pyridyl)piperazinyl)-2-methylphenyl]-4-(2-pyridyl)piperaz ine-2-carboxylic acid
| Molecular Formula | C27H30N6O4 |
|---|---|
| Molecular Weight | 502.23 g/mol |
| LogP | 2.34462 |
| Topological Polar Surface Area | 113.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 502.23285 |
| Heavy Atoms | 37 |
| Complexity | 1258.2659 |
Chemical Identifiers
| CAS Number | 337511-96-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2CCN(CC2C(=O)O)C3=CC=CC=N3)N4CCN(CC4C(=O)O)C5=CC=CC=N5 |
Product Overview
N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid (CAS 337511-96-3), with molecular formula C27H30N6O4 and molecular weight 502.23 g/mol. IUPAC: 1-[3-(2-carboxy-4-pyridin-2-ylpiperazin-1-yl)-4-methylphenyl]-4-pyridin-2-ylpiperazine-2-carboxylic acid.
Chemical Property Profile of N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid
Property Insights of N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid
The XLogP value of 2.34462 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid. The TPSA of 113.34 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid. Following Lipinski's Rule of Five, N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid?
The CAS number of N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid is 337511-96-3.
What is the molecular formula of N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid?
The molecular formula of N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid is C27H30N6O4.
What is the molecular weight of N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid?
The molecular weight of N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid is 502.23 g/mol.
Where can I buy N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid?
You can request a quote for N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for N,N-(2,4-Toluene)bis-4-(2-pyridinyl)-2-piperazinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.