2-(4-甲基哌嗪-1-基)烟酸
TL;DR: 2-(4-甲基哌嗪-1-基)烟酸 (CAS 55081-26-0) is a chemical compound with molecular formula C11H15N3O2 and molecular weight 221.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-甲基哌嗪-1-基)烟酸
2-(4-methylpiperazin-1-yl)pyridine-3-carboxylic acid
Also Known As: 2-(4-Methylpiperazin-1-yl)nicotinic acid, null, 2-(4-methylpiperazin-1-yl)pyridine-3-carboxylic acid, 2-(4-METHYL-1-PIPERAZINYL)NICOTINIC ACID, 4882AB
| Molecular Formula | C11H15N3O2 |
|---|---|
| Molecular Weight | 221.12 g/mol |
| LogP | -1.6 |
| Topological Polar Surface Area | 56.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.11642 |
| Heavy Atoms | 16 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 55081-26-0 |
|---|---|
| SMILES | CN1CCN(CC1)C2=C(C=CC=N2)C(=O)O |
| InChIKey | IKHWOUUYKLSAGZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-甲基哌嗪-1-基)烟酸 (CAS 55081-26-0), with molecular formula C11H15N3O2 and molecular weight 221.12 g/mol. IUPAC: 2-(4-methylpiperazin-1-yl)pyridine-3-carboxylic acid.
Chemical Property Profile of 2-(4-甲基哌嗪-1-基)烟酸
Property Insights of 2-(4-甲基哌嗪-1-基)烟酸
The XLogP value of -1.6 indicates that 2-(4-甲基哌嗪-1-基)烟酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 56.7 Ų, 2-(4-甲基哌嗪-1-基)烟酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-甲基哌嗪-1-基)烟酸 has 1 hydrogen bond donor(s) and 5 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 2-(4-甲基哌嗪-1-基)烟酸?
The CAS number of 2-(4-甲基哌嗪-1-基)烟酸 is 55081-26-0.
What is the molecular formula of 2-(4-甲基哌嗪-1-基)烟酸?
The molecular formula of 2-(4-甲基哌嗪-1-基)烟酸 is C11H15N3O2.
What is the molecular weight of 2-(4-甲基哌嗪-1-基)烟酸?
The molecular weight of 2-(4-甲基哌嗪-1-基)烟酸 is 221.12 g/mol.
Where can I buy 2-(4-甲基哌嗪-1-基)烟酸?
You can request a quote for 2-(4-甲基哌嗪-1-基)烟酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-甲基哌嗪-1-基)烟酸?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-甲基哌嗪-1-基)烟酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.