(S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid
TL;DR: (S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid (CAS 956752-63-9) is a chemical compound with molecular formula C21H23NO7 and molecular weight 401.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[2-[3-hydroxy-4-(2-phenoxyacetyl)phenoxy]acetyl]amino]-3-methylbutanoic acid
Also Known As: (2S)-2-[[2-[3-hydroxy-4-(2-phenoxyacetyl)phenoxy]acetyl]amino]-3-methylbutanoic acid, (S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid, 2-[[2-[3-hydroxy-4-(2-phenoxyacetyl)phenoxy]acetyl]amino]-3-methyl-butanoic Acid
| Molecular Formula | C21H23NO7 |
|---|---|
| Molecular Weight | 401.15 g/mol |
| LogP | 2.2581 |
| Topological Polar Surface Area | 122.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 401.14746 |
| Heavy Atoms | 29 |
| Complexity | 864.58826 |
Chemical Identifiers
| CAS Number | 956752-63-9 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)O)NC(=O)COC1=CC(=C(C=C1)C(=O)COC2=CC=CC=C2)O |
Product Overview
(S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid (CAS 956752-63-9), with molecular formula C21H23NO7 and molecular weight 401.15 g/mol. IUPAC: (2S)-2-[[2-[3-hydroxy-4-(2-phenoxyacetyl)phenoxy]acetyl]amino]-3-methylbutanoic acid.
Chemical Property Profile of (S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid
Property Insights of (S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid
The XLogP value of 2.2581 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid. The TPSA of 122.16 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid. Following Lipinski's Rule of Five, (S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid 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 (S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid?
The CAS number of (S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid is 956752-63-9.
What is the molecular formula of (S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid?
The molecular formula of (S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid is C21H23NO7.
What is the molecular weight of (S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid?
The molecular weight of (S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid is 401.15 g/mol.
Where can I buy (S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid?
You can request a quote for (S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-(2-(3-hydroxy-4-(2-phenoxyacetyl)phenoxy)acetamido)-3-methylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.