![3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid structure](/static/products/1566/1566-11-6.webp)
3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid
TL;DR: 3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid (CAS 1566-11-6) is a chemical compound with molecular formula C21H18FNO3 and molecular weight 351.12708 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)pyrrol-2-yl]propanoic acid
Also Known As: CBKinase1_003265, CBKinase1_015665, BRD-K39238054-001-01-9, 3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid, 3-(1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl)propanoic acid
Technical Specifications
| Molecular Formula | C21H18FNO3 |
| Molecular Weight | 351.12708 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 59.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 351.12708 Da |
| Heavy Atoms | 26 |
| Complexity | 495.0 |
| SMILES | CC(=O)C1=CC=C(C=C1)N2C(=CC=C2C3=CC=C(C=C3)F)CCC(=O)O |
| InChIKey | SETYZSTXWKXUAF-UHFFFAOYSA-N |
Chemical Property Profile of 3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid
Property Insights of 3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid
The XLogP value of 3.6 indicates that 3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.3 Ų, 3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid?
The CAS number of 3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid is 1566-11-6.
What is the molecular formula of 3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid?
The molecular formula of 3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid is C21H18FNO3.
What is the molecular weight of 3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid?
The molecular weight of 3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid is 351.12708 g/mol.
Where can I buy 3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid?
You can request a quote for 3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid?
Yes, CoreyChem provides custom synthesis services for 3-[1-(4-acetylphenyl)-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.