4-(1-Pyrenyl)butyryl-Phe-OH
TL;DR: 4-(1-Pyrenyl)butyryl-Phe-OH (CAS 199612-75-4) is a chemical compound with molecular formula C29H25NO3 and molecular weight 435.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-2-(4-pyren-1-ylbutanoylamino)propanoic acid
Also Known As: Py-Phe;Pba-Phe-OH, 4-(1-Pyrenyl)butyryl-Phe-OH, N-4-(1-Pyrene)butyroyl-L-phenylalanine, 3-phenyl-2-(4-pyren-1-ylbutanoylamino)propanoic Acid
| Molecular Formula | C29H25NO3 |
|---|---|
| Molecular Weight | 435.18 g/mol |
| LogP | 5.7188 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 435.18344 |
| Heavy Atoms | 33 |
| Complexity | 1425.8708 |
Chemical Identifiers
| CAS Number | 199612-75-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(C(=O)O)NC(=O)CCCC2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2 |
Product Overview
4-(1-Pyrenyl)butyryl-Phe-OH (CAS 199612-75-4), with molecular formula C29H25NO3 and molecular weight 435.18 g/mol. IUPAC: 3-phenyl-2-(4-pyren-1-ylbutanoylamino)propanoic acid.
Chemical Property Profile of 4-(1-Pyrenyl)butyryl-Phe-OH
Property Insights of 4-(1-Pyrenyl)butyryl-Phe-OH
The XLogP value of 5.7188 indicates that 4-(1-Pyrenyl)butyryl-Phe-OH is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(1-Pyrenyl)butyryl-Phe-OH. Following Lipinski's Rule of Five, 4-(1-Pyrenyl)butyryl-Phe-OH has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(1-Pyrenyl)butyryl-Phe-OH?
The CAS number of 4-(1-Pyrenyl)butyryl-Phe-OH is 199612-75-4.
What is the molecular formula of 4-(1-Pyrenyl)butyryl-Phe-OH?
The molecular formula of 4-(1-Pyrenyl)butyryl-Phe-OH is C29H25NO3.
What is the molecular weight of 4-(1-Pyrenyl)butyryl-Phe-OH?
The molecular weight of 4-(1-Pyrenyl)butyryl-Phe-OH is 435.18 g/mol.
Where can I buy 4-(1-Pyrenyl)butyryl-Phe-OH?
You can request a quote for 4-(1-Pyrenyl)butyryl-Phe-OH directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1-Pyrenyl)butyryl-Phe-OH?
Yes, KEHONG BIO provides custom synthesis services for 4-(1-Pyrenyl)butyryl-Phe-OH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.