Isovaleryl-valyl-valyl-statine phosphinate ethyl ester
TL;DR: Isovaleryl-valyl-valyl-statine phosphinate ethyl ester (CAS 128901-52-0) is a chemical compound with molecular formula C24H46N3O7P and molecular weight 519.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-ethoxy-2-oxoethyl)-[(1R)-3-methyl-1-[[(2S)-3-methyl-1-[[(2S)-3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]-1-oxobutan-2-yl]amino]butyl]phosphinic acid
Also Known As: Ivavvsta(P)oet, Iva-val-val-sta(P)oet, Isovaleryl-valyl-valyl-statine phosphinate ethyl ester, 3-bromo-2-hydrazinyl-5-methylpyridine, (2-ethoxy-2-oxoethyl)-[(1R)-3-methyl-1-[[(2S)-3-methyl-1-[[(2S)-3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]-1-oxobutan-2-yl]amino]butyl]phosphinic acid
| Molecular Formula | C24H46N3O7P |
|---|---|
| Molecular Weight | 519.31 g/mol |
| LogP | 2.636 |
| Topological Polar Surface Area | 150.9 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 15 |
| Exact Mass | 519.3073 |
| Heavy Atoms | 35 |
| Complexity | 768.2167 |
Chemical Identifiers
| CAS Number | 128901-52-0 |
|---|---|
| SMILES | CCOC(=O)CP(=O)([C@H](CC(C)C)N[C@@H](C(C)C)C(=O)NC(=O)[C@H](C(C)C)NC(=O)CC(C)C)O |
Product Overview
Isovaleryl-valyl-valyl-statine phosphinate ethyl ester (CAS 128901-52-0), with molecular formula C24H46N3O7P and molecular weight 519.31 g/mol. IUPAC: (2-ethoxy-2-oxoethyl)-[(1R)-3-methyl-1-[[(2S)-3-methyl-1-[[(2S)-3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]-1-oxobutan-2-yl]amino]butyl]phosphinic acid.
Chemical Property Profile of Isovaleryl-valyl-valyl-statine phosphinate ethyl ester
Property Insights of Isovaleryl-valyl-valyl-statine phosphinate ethyl ester
The XLogP value of 2.636 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isovaleryl-valyl-valyl-statine phosphinate ethyl ester. The TPSA of 150.9 Ų indicates high polarity, suggesting Isovaleryl-valyl-valyl-statine phosphinate ethyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Isovaleryl-valyl-valyl-statine phosphinate ethyl ester has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isovaleryl-valyl-valyl-statine phosphinate ethyl ester?
The CAS number of Isovaleryl-valyl-valyl-statine phosphinate ethyl ester is 128901-52-0.
What is the molecular formula of Isovaleryl-valyl-valyl-statine phosphinate ethyl ester?
The molecular formula of Isovaleryl-valyl-valyl-statine phosphinate ethyl ester is C24H46N3O7P.
What is the molecular weight of Isovaleryl-valyl-valyl-statine phosphinate ethyl ester?
The molecular weight of Isovaleryl-valyl-valyl-statine phosphinate ethyl ester is 519.31 g/mol.
Where can I buy Isovaleryl-valyl-valyl-statine phosphinate ethyl ester?
You can request a quote for Isovaleryl-valyl-valyl-statine phosphinate ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isovaleryl-valyl-valyl-statine phosphinate ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Isovaleryl-valyl-valyl-statine phosphinate ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.