2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid
TL;DR: 2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid (CAS 498535-08-3) is a chemical compound with molecular formula C26H23FN2O3 and molecular weight 430.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(2-fluorophenyl)-4-(4-methylanilino)-1-(4-methylphenyl)-5-oxo-2H-pyrrol-3-yl]acetic acid
Also Known As: 2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid, 2-[2-(2-FLUOROPHENYL)-1-(4-METHYLPHENYL)-4-[(4-METHYLPHENYL)AMINO]-5-OXO-2,5-DIHYDRO-1H-PYRROL-3-YL]ACETIC ACID, 2-[2-(2-fluorophenyl)-4-(4-methylanilino)-1-(4-methylphenyl)-5-oxo-2H-pyrrol-3-yl]acetic acid
| Molecular Formula | C26H23FN2O3 |
|---|---|
| Molecular Weight | 430.17 g/mol |
| LogP | 5.37134 |
| Topological Polar Surface Area | 69.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 430.16928 |
| Heavy Atoms | 32 |
| Complexity | 1200.5015 |
Chemical Identifiers
| CAS Number | 498535-08-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC2=C(C(N(C2=O)C3=CC=C(C=C3)C)C4=CC=CC=C4F)CC(=O)O |
Product Overview
2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid (CAS 498535-08-3), with molecular formula C26H23FN2O3 and molecular weight 430.17 g/mol. IUPAC: 2-[2-(2-fluorophenyl)-4-(4-methylanilino)-1-(4-methylphenyl)-5-oxo-2H-pyrrol-3-yl]acetic acid.
Chemical Property Profile of 2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid
Property Insights of 2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid
The XLogP value of 5.37134 indicates that 2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid. Following Lipinski's Rule of Five, 2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid?
The CAS number of 2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid is 498535-08-3.
What is the molecular formula of 2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid?
The molecular formula of 2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid is C26H23FN2O3.
What is the molecular weight of 2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid?
The molecular weight of 2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid is 430.17 g/mol.
Where can I buy 2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid?
You can request a quote for 2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-(2-fluorophenyl)-5-oxo-1-(p-tolyl)-4-(p-tolylamino)-2,5-dihydro-1H-pyrrol-3-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.