5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid
TL;DR: 5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid (CAS 435342-03-3) is a chemical compound with molecular formula C15H23NO3 and molecular weight 265.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-tert-butyl-2-(piperidin-1-ylmethyl)furan-3-carboxylic acid
Also Known As: Amafolone, 5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid, BAS 05240735, 5-tert-butyl-2-(piperidin-1-ylmethyl)furan-3-carboxylic acid, 5-(tert-Butyl)-2-(piperidin-1-ylmethyl)furan-3-carboxylic acid
| Molecular Formula | C15H23NO3 |
|---|---|
| Molecular Weight | 265.17 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 53.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 265.1678 |
| Heavy Atoms | 19 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 435342-03-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(O1)CN2CCCCC2)C(=O)O |
| InChIKey | HZNVDRXNGMBFSF-UHFFFAOYSA-N |
Product Overview
5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid (CAS 435342-03-3), with molecular formula C15H23NO3 and molecular weight 265.17 g/mol. IUPAC: 5-tert-butyl-2-(piperidin-1-ylmethyl)furan-3-carboxylic acid.
Chemical Property Profile of 5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid
Property Insights of 5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid. With a topological polar surface area (TPSA) of 53.7 Ų, 5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid 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 5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid?
The CAS number of 5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid is 435342-03-3.
What is the molecular formula of 5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid?
The molecular formula of 5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid is C15H23NO3.
What is the molecular weight of 5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid?
The molecular weight of 5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid is 265.17 g/mol.
Where can I buy 5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid?
You can request a quote for 5-tert-Butyl-2-piperidin-1-ylmethyl-furan-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 5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-tert-Butyl-2-piperidin-1-ylmethyl-furan-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.