(5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one
TL;DR: (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one (CAS 877794-41-7) is a chemical compound with molecular formula C20H16F3NO3 and molecular weight 375.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one
Also Known As: (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one, (5E)-3-hydroxy-1-(4-methylphenyl)-5-(2-oxo-2-phenylethylidene)-3-(trifluoromethyl)pyrrolidin-2-one, (E)-3-hydroxy-5-(2-oxo-2-phenylethylidene)-1-(p-tolyl)-3-(trifluoromethyl)pyrrolidin-2-one
| Molecular Formula | C20H16F3NO3 |
|---|---|
| Molecular Weight | 375.11 g/mol |
| LogP | 3.79192 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 375.10822 |
| Heavy Atoms | 27 |
| Complexity | 904.3192 |
Chemical Identifiers
| CAS Number | 877794-41-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2/C(=C/C(=O)C3=CC=CC=C3)/CC(C2=O)(C(F)(F)F)O |
Product Overview
(5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one (CAS 877794-41-7), with molecular formula C20H16F3NO3 and molecular weight 375.11 g/mol. IUPAC: (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one.
Chemical Property Profile of (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one
Property Insights of (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one
The XLogP value of 3.79192 indicates that (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.61 Ų, (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one has 1 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 (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one?
The CAS number of (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one is 877794-41-7.
What is the molecular formula of (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one?
The molecular formula of (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one is C20H16F3NO3.
What is the molecular weight of (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one?
The molecular weight of (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one is 375.11 g/mol.
Where can I buy (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one?
You can request a quote for (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for (5E)-3-hydroxy-1-(4-methylphenyl)-5-phenacylidene-3-(trifluoromethyl)pyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.