Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone
TL;DR: Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone (CAS 111682-13-4) is a chemical compound with molecular formula C20H31ClN4O7 and molecular weight 474.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[(2S)-1-[[(2S)-1-[[(2S)-1-[(2S)-4-chloro-3-oxobutan-2-yl]pyrrolidine-2-carbonyl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoate
Also Known As: MSACK, Elastase Inhibitor, MeOSuc-Ala-Ala-Pro-Ala-Chloromethylketone, Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone, methoxysuccinyl-Ala-Ala-Pro-Ala chloromethyl ketone
| Molecular Formula | C20H31ClN4O7 |
|---|---|
| Molecular Weight | 474.19 g/mol |
| LogP | -0.7474 |
| Topological Polar Surface Area | 150.98 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 474.18814 |
| Heavy Atoms | 32 |
| Complexity | 745.4599 |
Chemical Identifiers
| CAS Number | 111682-13-4 |
|---|---|
| SMILES | C[C@@H](C(=O)N[C@@H](C)C(=O)NC(=O)[C@@H]1CCCN1[C@@H](C)C(=O)CCl)NC(=O)CCC(=O)OC |
Product Overview
Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone (CAS 111682-13-4), with molecular formula C20H31ClN4O7 and molecular weight 474.19 g/mol. IUPAC: methyl 4-[[(2S)-1-[[(2S)-1-[[(2S)-1-[(2S)-4-chloro-3-oxobutan-2-yl]pyrrolidine-2-carbonyl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoate.
Chemical Property Profile of Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone
Property Insights of Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone
The XLogP value of -0.7474 indicates that Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 150.98 Ų indicates high polarity, suggesting Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone has 3 hydrogen bond donor(s) and 8 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 Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone?
The CAS number of Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone is 111682-13-4.
What is the molecular formula of Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone?
The molecular formula of Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone is C20H31ClN4O7.
What is the molecular weight of Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone?
The molecular weight of Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone is 474.19 g/mol.
Where can I buy Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone?
You can request a quote for Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone?
Yes, KEHONG BIO provides custom synthesis services for Methoxysuccinyl-alanyl-alanyl-prolyl-alanine chloromethyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.