Difelikefalin Impurity 6
TL;DR: Difelikefalin Impurity 6 (CAS 957006-52-9) is a chemical compound with molecular formula C24H29N3O4 and molecular weight 423.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[1-[(2S)-2-amino-3-phenylpropanoyl]piperidine-4-carbonyl]amino]-3-phenylpropanoic acid
Also Known As: Phe-Inp-Phe, Difelikefalin Impurity 6, N-{[1-(L-phenylalanyl)piperidin-4-yl]carbonyl}-L-phenylalanine, (1-(L-phenylalanyl)piperidine-4-carbonyl)-L-phenylalanine, 2-[[1-(2-amino-3-phenyl-propanoyl)piperidine-4-carbonyl]amino]-3-phenyl-propanoic Acid
| Molecular Formula | C24H29N3O4 |
|---|---|
| Molecular Weight | 423.22 g/mol |
| LogP | 1.6071 |
| Topological Polar Surface Area | 112.73 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 423.21582 |
| Heavy Atoms | 31 |
| Complexity | 880.2121 |
Chemical Identifiers
| CAS Number | 957006-52-9 |
|---|---|
| SMILES | C1CN(CCC1C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O)C(=O)[C@H](CC3=CC=CC=C3)N |
Product Overview
Difelikefalin Impurity 6 (CAS 957006-52-9), with molecular formula C24H29N3O4 and molecular weight 423.22 g/mol. IUPAC: (2S)-2-[[1-[(2S)-2-amino-3-phenylpropanoyl]piperidine-4-carbonyl]amino]-3-phenylpropanoic acid.
Chemical Property Profile of Difelikefalin Impurity 6
Property Insights of Difelikefalin Impurity 6
The XLogP value of 1.6071 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Difelikefalin Impurity 6. The TPSA of 112.73 Ų falls within the moderate polarity range, balancing permeability and solubility for Difelikefalin Impurity 6. Following Lipinski's Rule of Five, Difelikefalin Impurity 6 has 3 hydrogen bond donor(s) and 4 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 Difelikefalin Impurity 6?
The CAS number of Difelikefalin Impurity 6 is 957006-52-9.
What is the molecular formula of Difelikefalin Impurity 6?
The molecular formula of Difelikefalin Impurity 6 is C24H29N3O4.
What is the molecular weight of Difelikefalin Impurity 6?
The molecular weight of Difelikefalin Impurity 6 is 423.22 g/mol.
Where can I buy Difelikefalin Impurity 6?
You can request a quote for Difelikefalin Impurity 6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Difelikefalin Impurity 6?
Yes, KEHONG BIO provides custom synthesis services for Difelikefalin Impurity 6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.