alpha-APP Modulator
TL;DR: alpha-APP Modulator (CAS 497261-93-5) is a chemical compound with molecular formula C27H30F3N3O3 and molecular weight 501.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E,4E)-N-[(2S,5S)-5-(hydroxymethyl)-1-methyl-3-oxo-2-propan-2-yl-2,4,5,6-tetrahydro-1,4-benzodiazocin-8-yl]-5-[4-(trifluoromethyl)phenyl]penta-2,4-dienamide
Also Known As: tppb, alpha-APP Modulator, PKC Activator V, 5-methylsulfanylpent-4-en-2-one, Amyloid Precursor Protein Modulator
| Molecular Formula | C27H30F3N3O3 |
|---|---|
| Molecular Weight | 501.22 g/mol |
| LogP | 4.4075 |
| Topological Polar Surface Area | 81.67 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 501.22394 |
| Heavy Atoms | 36 |
| Complexity | 1141.1882 |
Chemical Identifiers
| CAS Number | 497261-93-5 |
|---|---|
| SMILES | CC(C)[C@H]1C(=O)N[C@@H](CC2=C(N1C)C=CC(=C2)NC(=O)/C=C/C=C/C3=CC=C(C=C3)C(F)(F)F)CO |
Product Overview
alpha-APP Modulator (CAS 497261-93-5), with molecular formula C27H30F3N3O3 and molecular weight 501.22 g/mol. IUPAC: (2E,4E)-N-[(2S,5S)-5-(hydroxymethyl)-1-methyl-3-oxo-2-propan-2-yl-2,4,5,6-tetrahydro-1,4-benzodiazocin-8-yl]-5-[4-(trifluoromethyl)phenyl]penta-2,4-dienamide.
Chemical Property Profile of alpha-APP Modulator
Property Insights of alpha-APP Modulator
The XLogP value of 4.4075 indicates that alpha-APP Modulator is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.67 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha-APP Modulator. Following Lipinski's Rule of Five, alpha-APP Modulator has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of alpha-APP Modulator?
The CAS number of alpha-APP Modulator is 497261-93-5.
What is the molecular formula of alpha-APP Modulator?
The molecular formula of alpha-APP Modulator is C27H30F3N3O3.
What is the molecular weight of alpha-APP Modulator?
The molecular weight of alpha-APP Modulator is 501.22 g/mol.
Where can I buy alpha-APP Modulator?
You can request a quote for alpha-APP Modulator directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-APP Modulator?
Yes, KEHONG BIO provides custom synthesis services for alpha-APP Modulator and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.