![[2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate structure](/static/products/5744/5744-98-9.webp)
[2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate
TL;DR: [2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate (CAS 5744-98-9) is a chemical compound with molecular formula C18H18FNO3 and molecular weight 315.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate
Also Known As: [2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate|2-oxo-2-(1,2,5-trimethyl-1H-pyrrol-3-yl)ethyl 3-(3-fluorophenyl)prop-2-enoate
| Molecular Formula | C18H18FNO3 |
|---|---|
| Molecular Weight | 315.13 g/mol |
| LogP | 3.22034 |
| Topological Polar Surface Area | 48.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.12708 |
| Heavy Atoms | 23 |
| Complexity | 774.56903 |
Chemical Identifiers
| CAS Number | 5744-98-9 |
|---|---|
| SMILES | CC1=CC(=C(N1C)C)C(=O)COC(=O)C=CC2=CC(=CC=C2)F |
Product Overview
[2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate (CAS 5744-98-9), with molecular formula C18H18FNO3 and molecular weight 315.13 g/mol. IUPAC: [2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate.
Chemical Property Profile of [2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate
Property Insights of [2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate
The XLogP value of 3.22034 indicates that [2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.3 Ų, [2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate has 0 hydrogen bond donor(s) and 3 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 [2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate?
The CAS number of [2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate is 5744-98-9.
What is the molecular formula of [2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate?
The molecular formula of [2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate is C18H18FNO3.
What is the molecular weight of [2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate?
The molecular weight of [2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate is 315.13 g/mol.
Where can I buy [2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate?
You can request a quote for [2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for [2-Oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-(3-fluorophenyl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.