5-Methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid
TL;DR: 5-Methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid (CAS 151258-65-0) is a chemical compound with molecular formula C16H13NO2S and molecular weight 283.0667 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid
Also Known As: 5-methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid, 2-butyl-1,3-diazaspiro[4.4]non-1-en-4-one,hydrochloride, 5-methyl-4-phenyl-2-(1H-pyrrol-1-yl)thiophene-3-carboxylic a, 5-methyl-4-phenyl-2-pyrrol-1-yl-thiophene-3-carboxylic Acid, 3-Thiophenecarboxylic acid, 5-methyl-4-phenyl-2-(1H-pyrrol-1-yl)-
Technical Specifications
| Molecular Formula | C16H13NO2S |
| Molecular Weight | 283.0667 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 70.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.0667 Da |
| Heavy Atoms | 20 |
| Complexity | 350.0 |
| SMILES | CC1=C(C(=C(S1)N2C=CC=C2)C(=O)O)C3=CC=CC=C3 |
| InChIKey | JUZLNSOSHUXHJQ-UHFFFAOYSA-N |
Chemical Property Profile of 5-Methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid
Property Insights of 5-Methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid
The XLogP value of 3.9 indicates that 5-Methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid. Following Lipinski's Rule of Five, 5-Methyl-4-phenyl-2-pyrrol-1-ylthiophene-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
What is the CAS number of 5-Methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid?
The CAS number of 5-Methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid is 151258-65-0.
What is the molecular formula of 5-Methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid?
The molecular formula of 5-Methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid is C16H13NO2S.
What is the molecular weight of 5-Methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid?
The molecular weight of 5-Methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid is 283.0667 g/mol.
Where can I buy 5-Methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid?
You can request a quote for 5-Methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 5-Methyl-4-phenyl-2-pyrrol-1-ylthiophene-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.