Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone
TL;DR: Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone (CAS 93044-77-0) is a chemical compound with molecular formula C24H28ClN3O5 and molecular weight 473.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-[(2S)-1-[[(2S)-2-[[(2S)-4-chloro-3-oxo-1-phenylbutan-2-yl]amino]propanoyl]amino]-1-oxopropan-2-yl]carbamate
Also Known As: Z-Ala-ala-phe-CH2CL, Benzyloxycarbonyl-ala-ala-phe-chloromethyl ketone, (S)-N-((Phenylmethoxy)carbonyl)-L-alanyl-N-(3-chloro-2-oxo-1-(phenylmethyl)propyl)-L-alaninamide, Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone, benzyl N-[(2S)-1-[[(2S)-2-[[(2S)-4-chloro-3-oxo-1-phenylbutan-2-yl]amino]propanoyl]amino]-1-oxopropan-2-yl]carbamate
| Molecular Formula | C24H28ClN3O5 |
|---|---|
| Molecular Weight | 473.17 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 473.17175 |
| Heavy Atoms | 33 |
| Complexity | 662.0 |
Chemical Identifiers
| CAS Number | 93044-77-0 |
|---|---|
| SMILES | C[C@@H](C(=O)NC(=O)[C@H](C)NC(=O)OCC1=CC=CC=C1)N[C@@H](CC2=CC=CC=C2)C(=O)CCl |
| InChIKey | GVXFHFRNYPQKLM-ZWOKBUDYSA-N |
Product Overview
Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone (CAS 93044-77-0), with molecular formula C24H28ClN3O5 and molecular weight 473.17 g/mol. IUPAC: benzyl N-[(2S)-1-[[(2S)-2-[[(2S)-4-chloro-3-oxo-1-phenylbutan-2-yl]amino]propanoyl]amino]-1-oxopropan-2-yl]carbamate.
Chemical Property Profile of Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone
Property Insights of Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone
The XLogP value of 3.3 indicates that Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone. Following Lipinski's Rule of Five, Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone has 3 hydrogen bond donor(s) and 6 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 Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone?
The CAS number of Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone is 93044-77-0.
What is the molecular formula of Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone?
The molecular formula of Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone is C24H28ClN3O5.
What is the molecular weight of Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone?
The molecular weight of Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone is 473.17 g/mol.
Where can I buy Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone?
You can request a quote for Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone?
Yes, KEHONG BIO provides custom synthesis services for Benzyloxycarbonylalanyl-alanyl phenylalanine chloromethyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.