(S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid
TL;DR: (S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid (CAS 956691-31-9) is a chemical compound with molecular formula C21H26N2O7 and molecular weight 418.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[2-[[2-(4-ethyl-8-methyl-2-oxochromen-7-yl)oxyacetyl]amino]acetyl]amino]-3-methylbutanoic acid
Also Known As: (S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid, (2S)-2-[[2-[[2-(4-ethyl-8-methyl-2-oxochromen-7-yl)oxyacetyl]amino]acetyl]amino]-3-methylbutanoic acid
| Molecular Formula | C21H26N2O7 |
|---|---|
| Molecular Weight | 418.17 g/mol |
| LogP | 1.38422 |
| Topological Polar Surface Area | 134.94 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 418.174 |
| Heavy Atoms | 30 |
| Complexity | 1010.3173 |
Chemical Identifiers
| CAS Number | 956691-31-9 |
|---|---|
| SMILES | CCC1=CC(=O)OC2=C1C=CC(=C2C)OCC(=O)NCC(=O)N[C@@H](C(C)C)C(=O)O |
Product Overview
(S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid (CAS 956691-31-9), with molecular formula C21H26N2O7 and molecular weight 418.17 g/mol. IUPAC: (2S)-2-[[2-[[2-(4-ethyl-8-methyl-2-oxochromen-7-yl)oxyacetyl]amino]acetyl]amino]-3-methylbutanoic acid.
Chemical Property Profile of (S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid
Property Insights of (S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid
The XLogP value of 1.38422 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid. The TPSA of 134.94 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid. Following Lipinski's Rule of Five, (S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)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-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid?
The CAS number of (S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid is 956691-31-9.
What is the molecular formula of (S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid?
The molecular formula of (S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid is C21H26N2O7.
What is the molecular weight of (S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid?
The molecular weight of (S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid is 418.17 g/mol.
Where can I buy (S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid?
You can request a quote for (S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)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-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-(2-(2-((4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)acetamido)-3-methylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.