(2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate
TL;DR: (2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate (CAS 5767-35-1) is a chemical compound with molecular formula C27H28N2O4 and molecular weight 444.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S)-2-[(2-benzamido-3-phenylpropanoyl)amino]-3-phenylpropyl] acetate
Also Known As: Aurantiamide acetate, Asperglaucide, Lyciumamide, Asperglaucide, Lyciumamide, N-Benzoyl-phe-phe-ol-acetate
| Molecular Formula | C27H28N2O4 |
|---|---|
| Molecular Weight | 444.20 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 444.2049 |
| Heavy Atoms | 33 |
| Complexity | 620.0 |
Chemical Identifiers
| CAS Number | 5767-35-1 |
|---|---|
| SMILES | CC(=O)OC[C@H](CC1=CC=CC=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3 |
| InChIKey | VZPAURMDJZOGHU-SKCDSABHSA-N |
Product Overview
(2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate (CAS 5767-35-1), with molecular formula C27H28N2O4 and molecular weight 444.20 g/mol. IUPAC: [(2S)-2-[(2-benzamido-3-phenylpropanoyl)amino]-3-phenylpropyl] acetate.
Chemical Property Profile of (2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate
Property Insights of (2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate
The XLogP value of 4.4 indicates that (2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate. Following Lipinski's Rule of Five, (2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate has 2 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 (2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate?
The CAS number of (2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate is 5767-35-1.
What is the molecular formula of (2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate?
The molecular formula of (2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate is C27H28N2O4.
What is the molecular weight of (2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate?
The molecular weight of (2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate is 444.20 g/mol.
Where can I buy (2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate?
You can request a quote for (2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate?
Yes, KEHONG BIO provides custom synthesis services for (2s)-2-[(n-Benzoylphenylalanyl)amino]-3-phenylpropyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.