3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid
TL;DR: 3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid (CAS 866019-33-2) is a chemical compound with molecular formula C11H11NO2S and molecular weight 221.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-pyrrol-1-yl-3-thiophen-3-ylpropanoic acid
Also Known As: 3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid, Bionet2_001212, 3-(1H-pyrrol-1-yl)-3-(3-thienyl)propanoic acid, pyrrolylthienylpropanoicacid, 3-pyrrol-1-yl-3-thiophen-3-ylpropanoic acid
| Molecular Formula | C11H11NO2S |
|---|---|
| Molecular Weight | 221.05 g/mol |
| LogP | 2.6137 |
| Topological Polar Surface Area | 42.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 221.05106 |
| Heavy Atoms | 15 |
| Complexity | 385.14722 |
Chemical Identifiers
| CAS Number | 866019-33-2 |
|---|---|
| SMILES | C1=CN(C=C1)C(CC(=O)O)C2=CSC=C2 |
Product Overview
3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid (CAS 866019-33-2), with molecular formula C11H11NO2S and molecular weight 221.05 g/mol. IUPAC: 3-pyrrol-1-yl-3-thiophen-3-ylpropanoic acid.
Chemical Property Profile of 3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid
Property Insights of 3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid
The XLogP value of 2.6137 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid. With a topological polar surface area (TPSA) of 42.23 Ų, 3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid has 1 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-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid?
The CAS number of 3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid is 866019-33-2.
What is the molecular formula of 3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid?
The molecular formula of 3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid is C11H11NO2S.
What is the molecular weight of 3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid?
The molecular weight of 3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid is 221.05 g/mol.
Where can I buy 3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid?
You can request a quote for 3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.