5-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid
TL;DR: 5-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid (CAS 697238-00-9) is a chemical compound with molecular formula C13H19NO3 and molecular weight 237.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid
Also Known As: 5-propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid, BAS 09902345, 5-Propyl-4-pyrrolidin-1-ylmethyl-furan-2-carboxylic acid, 5-propyl-4-(1-pyrrolidinylmethyl)-2-furancarboxylic acid, BRD-K38175504-001-01-0
| Molecular Formula | C13H19NO3 |
|---|---|
| Molecular Weight | 237.14 g/mol |
| LogP | 2.5261 |
| Topological Polar Surface Area | 53.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 237.13649 |
| Heavy Atoms | 17 |
| Complexity | 391.36887 |
Chemical Identifiers
| CAS Number | 697238-00-9 |
|---|---|
| SMILES | CCCC1=C(C=C(O1)C(=O)O)CN2CCCC2 |
Product Overview
5-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid (CAS 697238-00-9), with molecular formula C13H19NO3 and molecular weight 237.14 g/mol. IUPAC: 5-propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid.
Chemical Property Profile of 5-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid
Property Insights of 5-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid
The XLogP value of 2.5261 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid. With a topological polar surface area (TPSA) of 53.68 Ų, 5-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-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 5-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid?
The CAS number of 5-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid is 697238-00-9.
What is the molecular formula of 5-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid?
The molecular formula of 5-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid is C13H19NO3.
What is the molecular weight of 5-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid?
The molecular weight of 5-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid is 237.14 g/mol.
Where can I buy 5-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid?
You can request a quote for 5-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-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-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Propyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.