BIM-0012949.P001
TL;DR: BIM-0012949.P001 (CAS 425424-98-2) is a chemical compound with molecular formula C26H17F3N2O5 and molecular weight 494.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-2-(4-nitrophenyl)-3-[(E)-3-phenylprop-2-enoyl]-1-[3-(trifluoromethyl)phenyl]-2H-pyrrol-5-one
Also Known As: BIM-0012949.P001, 4-hydroxy-2-(4-nitrophenyl)-3-[(E)-3-phenylprop-2-enoyl]-1-[3-(trifluoromethyl)phenyl]-2H-pyrrol-5-one, 4-cinnamoyl-3-hydroxy-5-(4-nitrophenyl)-1-(3-(trifluoromethyl)phenyl)-1H-pyrrol-2(5H)-one, (4Z)-4-[(2E)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-5-(4-nitrophenyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione, 2H-Pyrrol-2-one, 5-(4-nitrophenyl)-1,5-dihydro-3-hydroxy-1-(3-trifluoromethylphenyl)-4-[(2E)-1-oxo-3-phenyl-2-propenyl]-
| Molecular Formula | C26H17F3N2O5 |
|---|---|
| Molecular Weight | 494.11 g/mol |
| LogP | 5.7961 |
| Topological Polar Surface Area | 100.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 494.10895 |
| Heavy Atoms | 36 |
| Complexity | 1397.082 |
Chemical Identifiers
| CAS Number | 425424-98-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C(=O)C2=C(C(=O)N(C2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC(=C4)C(F)(F)F)O |
Product Overview
BIM-0012949.P001 (CAS 425424-98-2), with molecular formula C26H17F3N2O5 and molecular weight 494.11 g/mol. IUPAC: 4-hydroxy-2-(4-nitrophenyl)-3-[(E)-3-phenylprop-2-enoyl]-1-[3-(trifluoromethyl)phenyl]-2H-pyrrol-5-one.
Chemical Property Profile of BIM-0012949.P001
Property Insights of BIM-0012949.P001
The XLogP value of 5.7961 indicates that BIM-0012949.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.75 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0012949.P001. Following Lipinski's Rule of Five, BIM-0012949.P001 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0012949.P001?
The CAS number of BIM-0012949.P001 is 425424-98-2.
What is the molecular formula of BIM-0012949.P001?
The molecular formula of BIM-0012949.P001 is C26H17F3N2O5.
What is the molecular weight of BIM-0012949.P001?
The molecular weight of BIM-0012949.P001 is 494.11 g/mol.
Where can I buy BIM-0012949.P001?
You can request a quote for BIM-0012949.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0012949.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0012949.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.