Acetylphenyl-alanyl-lysine chloromethyl ketone
TL;DR: Acetylphenyl-alanyl-lysine chloromethyl ketone (CAS 76157-63-6) is a chemical compound with molecular formula C18H26ClN3O3 and molecular weight 367.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-acetamido-N-[(3S)-7-amino-1-chloro-2-oxoheptan-3-yl]-3-phenylpropanamide
Also Known As: Acetyl-phe-lys-chloromethyl ketone, Acetylphenyl-alanyl-lysine chloromethyl ketone, Benzenepropanamide, alpha-(acetylamino)-N-(5-amino-1-(chloroacetyl)pentyl)-, (S-(R*,R*))-, (2S)-2-acetamido-N-[(3S)-7-amino-1-chloro-2-oxoheptan-3-yl]-3-phenylpropanamide, (2S)-N-[(3S)-7-Amino-1-chloro-2-oxoheptan-3-yl]-2-[(1-hydroxyethylidene)amino]-3-phenylpropanimidic acid
| Molecular Formula | C18H26ClN3O3 |
|---|---|
| Molecular Weight | 367.17 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 367.16626 |
| Heavy Atoms | 25 |
| Complexity | 439.0 |
Chemical Identifiers
| CAS Number | 76157-63-6 |
|---|---|
| SMILES | CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCCN)C(=O)CCl |
| InChIKey | NFWHCRXYRQNWPY-HOTGVXAUSA-N |
Product Overview
Acetylphenyl-alanyl-lysine chloromethyl ketone (CAS 76157-63-6), with molecular formula C18H26ClN3O3 and molecular weight 367.17 g/mol. IUPAC: (2S)-2-acetamido-N-[(3S)-7-amino-1-chloro-2-oxoheptan-3-yl]-3-phenylpropanamide.
Chemical Property Profile of Acetylphenyl-alanyl-lysine chloromethyl ketone
Property Insights of Acetylphenyl-alanyl-lysine chloromethyl ketone
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetylphenyl-alanyl-lysine chloromethyl ketone. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetylphenyl-alanyl-lysine chloromethyl ketone. Following Lipinski's Rule of Five, Acetylphenyl-alanyl-lysine chloromethyl ketone 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 Acetylphenyl-alanyl-lysine chloromethyl ketone?
The CAS number of Acetylphenyl-alanyl-lysine chloromethyl ketone is 76157-63-6.
What is the molecular formula of Acetylphenyl-alanyl-lysine chloromethyl ketone?
The molecular formula of Acetylphenyl-alanyl-lysine chloromethyl ketone is C18H26ClN3O3.
What is the molecular weight of Acetylphenyl-alanyl-lysine chloromethyl ketone?
The molecular weight of Acetylphenyl-alanyl-lysine chloromethyl ketone is 367.17 g/mol.
Where can I buy Acetylphenyl-alanyl-lysine chloromethyl ketone?
You can request a quote for Acetylphenyl-alanyl-lysine chloromethyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetylphenyl-alanyl-lysine chloromethyl ketone?
Yes, KEHONG BIO provides custom synthesis services for Acetylphenyl-alanyl-lysine chloromethyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.