1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine
TL;DR: 1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine (CAS 61338-13-4) is a chemical compound with molecular formula C17H19N3O2 and molecular weight 297.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methyl-2-phenylpiperazin-1-yl)pyridine-3-carboxylic acid
Also Known As: 2-(4-Methyl-2-phenylpiperazin-1-yl)nicotinic acid, Not Available, Mirtazapine carboxylic acid, Mirtazapine Impurity 7, Mirtazapine Impurity 18
| Molecular Formula | C17H19N3O2 |
|---|---|
| Molecular Weight | 297.15 g/mol |
| LogP | 2.2729 |
| Topological Polar Surface Area | 56.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.14774 |
| Heavy Atoms | 22 |
| Complexity | 659.96344 |
Chemical Identifiers
| CAS Number | 61338-13-4 |
|---|---|
| SMILES | CN1CCN(C(C1)C2=CC=CC=C2)C3=C(C=CC=N3)C(=O)O |
Product Overview
1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine (CAS 61338-13-4), with molecular formula C17H19N3O2 and molecular weight 297.15 g/mol. IUPAC: 2-(4-methyl-2-phenylpiperazin-1-yl)pyridine-3-carboxylic acid.
Chemical Property Profile of 1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine
Property Insights of 1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine
The XLogP value of 2.2729 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine. With a topological polar surface area (TPSA) of 56.67 Ų, 1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine has 1 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 1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine?
The CAS number of 1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine is 61338-13-4.
What is the molecular formula of 1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine?
The molecular formula of 1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine is C17H19N3O2.
What is the molecular weight of 1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine?
The molecular weight of 1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine is 297.15 g/mol.
Where can I buy 1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine?
You can request a quote for 1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.