3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid
TL;DR: 3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid (CAS 329217-03-0) is a chemical compound with molecular formula C14H15NO2 and molecular weight 229.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-(4-methylphenyl)-1H-pyrrol-2-yl]propanoic acid
Also Known As: 3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid, TimTec1_007247, 3-(5-(p-Tolyl)-1H-pyrrol-2-yl)propanoic acid, 3-[5-(4-methylphenyl)-1H-pyrrol-2-yl]propanoic acid, 3317AE
| Molecular Formula | C14H15NO2 |
|---|---|
| Molecular Weight | 229.11 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 53.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 229.11028 |
| Heavy Atoms | 17 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 329217-03-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CC=C(N2)CCC(=O)O |
| InChIKey | WZGDOFSPJPDKIO-UHFFFAOYSA-N |
Product Overview
3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid (CAS 329217-03-0), with molecular formula C14H15NO2 and molecular weight 229.11 g/mol. IUPAC: 3-[5-(4-methylphenyl)-1H-pyrrol-2-yl]propanoic acid.
Chemical Property Profile of 3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid
Property Insights of 3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid. With a topological polar surface area (TPSA) of 53.1 Ų, 3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid has 2 hydrogen bond donor(s) and 2 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 3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid?
The CAS number of 3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid is 329217-03-0.
What is the molecular formula of 3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid?
The molecular formula of 3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid is C14H15NO2.
What is the molecular weight of 3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid?
The molecular weight of 3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid is 229.11 g/mol.
Where can I buy 3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid?
You can request a quote for 3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-p-Tolyl-1H-pyrrol-2-yl)-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.