![3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid structure](/static/products/6827/682759-83-7.webp)
3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid
TL;DR: 3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid (CAS 682759-83-7) is a chemical compound with molecular formula C20H15BrF3NO2 and molecular weight 437.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]pyrrol-2-yl]propanoic acid
Also Known As: A2990/0125984, 3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid, 3-(5-(4-bromophenyl)-1-(3-(trifluoromethyl)phenyl)-1H-pyrrol-2-yl)propanoic acid, 3-[5-(4-BROMOPHENYL)-1-[3-(TRIFLUOROMETHYL)PHENYL]-1H-PYRROL-2-YL]PROPANOIC ACID, 3-[5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]pyrrol-2-yl]propanoic acid
| Molecular Formula | C20H15BrF3NO2 |
|---|---|
| Molecular Weight | 437.02 g/mol |
| LogP | 5.9428 |
| Topological Polar Surface Area | 42.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 437.02383 |
| Heavy Atoms | 27 |
| Complexity | 962.10333 |
Chemical Identifiers
| CAS Number | 682759-83-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)N2C(=CC=C2C3=CC=C(C=C3)Br)CCC(=O)O)C(F)(F)F |
Product Overview
3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid (CAS 682759-83-7), with molecular formula C20H15BrF3NO2 and molecular weight 437.02 g/mol. IUPAC: 3-[5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]pyrrol-2-yl]propanoic acid.
Chemical Property Profile of 3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid
Property Insights of 3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid
The XLogP value of 5.9428 indicates that 3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-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 42.23 Ų, 3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid?
The CAS number of 3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid is 682759-83-7.
What is the molecular formula of 3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid?
The molecular formula of 3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid is C20H15BrF3NO2.
What is the molecular weight of 3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid?
The molecular weight of 3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid is 437.02 g/mol.
Where can I buy 3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid?
You can request a quote for 3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-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-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-{5-(4-bromophenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.