Ala-Ala-Pro-Val-Chloromethylketone
TL;DR: Ala-Ala-Pro-Val-Chloromethylketone (CAS 90105-47-8) is a chemical compound with molecular formula C17H29ClN4O4 and molecular weight 388.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-1-[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]-N-[(3S)-1-chloro-4-methyl-2-oxopentan-3-yl]pyrrolidine-2-carboxamide
Also Known As: Ala-Ala-Pro-Val-CMK, Ala-Ala-Pro-Val-Chloromethylketone, AAPV-CMK, H-Ala-Ala-Pro-Val-chloromethylketone, Ala-Ala-Pro-Val-CH2Cl
| Molecular Formula | C17H29ClN4O4 |
|---|---|
| Molecular Weight | 388.19 g/mol |
| LogP | -0.222 |
| Topological Polar Surface Area | 121.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 388.18774 |
| Heavy Atoms | 26 |
| Complexity | 552.881 |
Chemical Identifiers
| CAS Number | 90105-47-8 |
|---|---|
| SMILES | C[C@@H](C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)CCl)N |
Product Overview
Ala-Ala-Pro-Val-Chloromethylketone (CAS 90105-47-8), with molecular formula C17H29ClN4O4 and molecular weight 388.19 g/mol. IUPAC: (2S)-1-[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]-N-[(3S)-1-chloro-4-methyl-2-oxopentan-3-yl]pyrrolidine-2-carboxamide.
Chemical Property Profile of Ala-Ala-Pro-Val-Chloromethylketone
Property Insights of Ala-Ala-Pro-Val-Chloromethylketone
The XLogP value of -0.222 indicates that Ala-Ala-Pro-Val-Chloromethylketone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 121.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Ala-Ala-Pro-Val-Chloromethylketone. Following Lipinski's Rule of Five, Ala-Ala-Pro-Val-Chloromethylketone has 3 hydrogen bond donor(s) and 5 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 Ala-Ala-Pro-Val-Chloromethylketone?
The CAS number of Ala-Ala-Pro-Val-Chloromethylketone is 90105-47-8.
What is the molecular formula of Ala-Ala-Pro-Val-Chloromethylketone?
The molecular formula of Ala-Ala-Pro-Val-Chloromethylketone is C17H29ClN4O4.
What is the molecular weight of Ala-Ala-Pro-Val-Chloromethylketone?
The molecular weight of Ala-Ala-Pro-Val-Chloromethylketone is 388.19 g/mol.
Where can I buy Ala-Ala-Pro-Val-Chloromethylketone?
You can request a quote for Ala-Ala-Pro-Val-Chloromethylketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ala-Ala-Pro-Val-Chloromethylketone?
Yes, KEHONG BIO provides custom synthesis services for Ala-Ala-Pro-Val-Chloromethylketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.