N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide
TL;DR: N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide (CAS 714255-77-3) is a chemical compound with molecular formula C29H21F7N2O3 and molecular weight 578.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-benzoyl-1-[2-(4-fluorophenyl)ethyl]-5-methyl-2-oxo-3-(trifluoromethyl)pyrrol-3-yl]-3-(trifluoromethyl)benzamide
Also Known As: N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide, N-[4-benzoyl-1-[2-(4-fluorophenyl)ethyl]-5-methyl-2-oxo-3-(trifluoromethyl)pyrrol-3-yl]-3-(trifluoromethyl)benzamide, N-{1-[2-(4-fluorophenyl)ethyl]-5-methyl-2-oxo-4-(phenylcarbonyl)-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl}-3-(trifluoromethyl)benzamide
| Molecular Formula | C29H21F7N2O3 |
|---|---|
| Molecular Weight | 578.14 g/mol |
| LogP | 6.1172 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 578.14404 |
| Heavy Atoms | 41 |
| Complexity | 1513.855 |
Chemical Identifiers
| CAS Number | 714255-77-3 |
|---|---|
| SMILES | CC1=C(C(C(=O)N1CCC2=CC=C(C=C2)F)(C(F)(F)F)NC(=O)C3=CC(=CC=C3)C(F)(F)F)C(=O)C4=CC=CC=C4 |
Product Overview
N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide (CAS 714255-77-3), with molecular formula C29H21F7N2O3 and molecular weight 578.14 g/mol. IUPAC: N-[4-benzoyl-1-[2-(4-fluorophenyl)ethyl]-5-methyl-2-oxo-3-(trifluoromethyl)pyrrol-3-yl]-3-(trifluoromethyl)benzamide.
Chemical Property Profile of N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide
Property Insights of N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide
The XLogP value of 6.1172 indicates that N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide. Following Lipinski's Rule of Five, N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide has 1 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 N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide?
The CAS number of N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide is 714255-77-3.
What is the molecular formula of N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide?
The molecular formula of N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide is C29H21F7N2O3.
What is the molecular weight of N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide?
The molecular weight of N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide is 578.14 g/mol.
Where can I buy N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide?
You can request a quote for N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-benzoyl-1-(4-fluorophenethyl)-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-3-(trifluoromethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.