4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid
TL;DR: 4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid (CAS 144314-68-1) is a chemical compound with molecular formula C15H21NO2 and molecular weight 247.15723 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid
Also Known As: pyrrolostatin, 4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid, 4-(3,7-dimethylocta-2,6-dien-1-yl)-1H-pyrrole-2-carboxylic acid
Technical Specifications
| Molecular Formula | C15H21NO2 |
| Molecular Weight | 247.15723 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 53.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 247.15723 Da |
| Heavy Atoms | 18 |
| Complexity | 340.0 |
| SMILES | CC(=CCCC(=CCC1=CNC(=C1)C(=O)O)C)C |
| InChIKey | UEQIBCOZMSTCSW-UHFFFAOYSA-N |
Chemical Property Profile of 4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid
Property Insights of 4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid
The XLogP value of 4.4 indicates that 4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.1 Ų, 4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic 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
What is the CAS number of 4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid?
The CAS number of 4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid is 144314-68-1.
What is the molecular formula of 4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid?
The molecular formula of 4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid is C15H21NO2.
What is the molecular weight of 4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid?
The molecular weight of 4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid is 247.15723 g/mol.
Where can I buy 4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid?
You can request a quote for 4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 4-(3,7-dimethylocta-2,6-dienyl)-1H-pyrrole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.