F0626-0004
TL;DR: F0626-0004 (CAS 477181-49-0) is a chemical compound with molecular formula C16H17F3N2O2 and molecular weight 326.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methylphenyl)-1-[(E)-4,4,4-trifluoro-3-oxobut-1-enyl]pyrrolidine-2-carboxamide
Also Known As: F0626-0004, N-(4-methylphenyl)-1-[(1E)-4,4,4-trifluoro-3-oxobut-1-en-1-yl]pyrrolidine-2-carboxamide, N-(4-methylphenyl)-1-[(E)-4,4,4-trifluoro-3-oxobut-1-enyl]pyrrolidine-2-carboxamide, (E)-N-(p-tolyl)-1-(4,4,4-trifluoro-3-oxobut-1-en-1-yl)pyrrolidine-2-carboxamide
| Molecular Formula | C16H17F3N2O2 |
|---|---|
| Molecular Weight | 326.12 g/mol |
| LogP | 3.04302 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.1242 |
| Heavy Atoms | 23 |
| Complexity | 608.7465 |
Chemical Identifiers
| CAS Number | 477181-49-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)C2CCCN2/C=C/C(=O)C(F)(F)F |
Product Overview
F0626-0004 (CAS 477181-49-0), with molecular formula C16H17F3N2O2 and molecular weight 326.12 g/mol. IUPAC: N-(4-methylphenyl)-1-[(E)-4,4,4-trifluoro-3-oxobut-1-enyl]pyrrolidine-2-carboxamide.
Chemical Property Profile of F0626-0004
Property Insights of F0626-0004
The XLogP value of 3.04302 indicates that F0626-0004 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, F0626-0004 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0626-0004 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 F0626-0004?
The CAS number of F0626-0004 is 477181-49-0.
What is the molecular formula of F0626-0004?
The molecular formula of F0626-0004 is C16H17F3N2O2.
What is the molecular weight of F0626-0004?
The molecular weight of F0626-0004 is 326.12 g/mol.
Where can I buy F0626-0004?
You can request a quote for F0626-0004 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0626-0004?
Yes, KEHONG BIO provides custom synthesis services for F0626-0004 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.