1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid
TL;DR: 1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid (CAS 896052-07-6) is a chemical compound with molecular formula C12H17NO2S and molecular weight 239.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic acid
Also Known As: starbld0025111, 1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid, 1-((5-Methylthiophen-2-yl)methyl)piperidine-3-carboxylic acid, F1908-2856
| Molecular Formula | C12H17NO2S |
|---|---|
| Molecular Weight | 239.10 g/mol |
| LogP | 2.35312 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 239.098 |
| Heavy Atoms | 16 |
| Complexity | 374.8506 |
Chemical Identifiers
| CAS Number | 896052-07-6 |
|---|---|
| SMILES | CC1=CC=C(S1)CN2CCCC(C2)C(=O)O |
Product Overview
1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid (CAS 896052-07-6), with molecular formula C12H17NO2S and molecular weight 239.10 g/mol. IUPAC: 1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic acid.
Chemical Property Profile of 1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid
Property Insights of 1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid
The XLogP value of 2.35312 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid. With a topological polar surface area (TPSA) of 40.54 Ų, 1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid has 1 hydrogen bond donor(s) and 3 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-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid?
The CAS number of 1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid is 896052-07-6.
What is the molecular formula of 1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid?
The molecular formula of 1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid is C12H17NO2S.
What is the molecular weight of 1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid?
The molecular weight of 1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid is 239.10 g/mol.
Where can I buy 1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid?
You can request a quote for 1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid?
Yes, KEHONG BIO provides custom synthesis services for 1-[(5-methylthiophen-2-yl)methyl]piperidine-3-carboxylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.