![(S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid structure](/static/products/956/956044-02-3.png)
(S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid
TL;DR: (S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid (CAS 956044-02-3) is a chemical compound with molecular formula C21H21NO6S and molecular weight 415.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[2-(4-methyl-6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]-4-methylsulfanylbutanoic acid
Also Known As: (S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid, N-{[(4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy]acetyl}-L-methionine, (2S)-2-[[2-(4-methyl-6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]-4-methylsulfanylbutanoic acid
| Molecular Formula | C21H21NO6S |
|---|---|
| Molecular Weight | 415.11 g/mol |
| LogP | 2.95592 |
| Topological Polar Surface Area | 105.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 415.10895 |
| Heavy Atoms | 29 |
| Complexity | 1123.2954 |
Chemical Identifiers
| CAS Number | 956044-02-3 |
|---|---|
| SMILES | CC1=C(C=CC2=C1OC(=O)C3=CC=CC=C23)OCC(=O)N[C@@H](CCSC)C(=O)O |
Product Overview
(S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid (CAS 956044-02-3), with molecular formula C21H21NO6S and molecular weight 415.11 g/mol. IUPAC: (2S)-2-[[2-(4-methyl-6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]-4-methylsulfanylbutanoic acid.
Chemical Property Profile of (S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid
Property Insights of (S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid
The XLogP value of 2.95592 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid. The TPSA of 105.84 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid. Following Lipinski's Rule of Five, (S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid has 2 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-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid?
The CAS number of (S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid is 956044-02-3.
What is the molecular formula of (S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid?
The molecular formula of (S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid is C21H21NO6S.
What is the molecular weight of (S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid?
The molecular weight of (S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid is 415.11 g/mol.
Where can I buy (S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid?
You can request a quote for (S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic 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-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-4-(methylthio)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.