(S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid
TL;DR: (S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid (CAS 956044-23-8) is a chemical compound with molecular formula C19H23NO6S and molecular weight 393.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-4-methylsulfanyl-2-[[2-(3,4,8-trimethyl-2-oxochromen-7-yl)oxyacetyl]amino]butanoic acid
Also Known As: (S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid, N-{[(3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}-L-methionine, 4-methylsulfanyl-2-[[2-(3,4,8-trimethyl-2-oxo-chromen-7-yl)oxyacetyl]amino]butanoic Acid, (2S)-4-(METHYLSULFANYL)-2-({2-[(3,4,8-TRIMETHYL-2-OXO-2H-CHROMEN-7-YL)OXY]ACETYL}AMINO)BUTANOIC ACID, (2S)-4-methylsulfanyl-2-[[2-(3,4,8-trimethyl-2-oxochromen-7-yl)oxyacetyl]amino]butanoic acid
| Molecular Formula | C19H23NO6S |
|---|---|
| Molecular Weight | 393.12 g/mol |
| LogP | 2.41956 |
| Topological Polar Surface Area | 105.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 393.1246 |
| Heavy Atoms | 27 |
| Complexity | 920.5363 |
Chemical Identifiers
| CAS Number | 956044-23-8 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC(=O)N[C@@H](CCSC)C(=O)O)C |
Product Overview
(S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid (CAS 956044-23-8), with molecular formula C19H23NO6S and molecular weight 393.12 g/mol. IUPAC: (2S)-4-methylsulfanyl-2-[[2-(3,4,8-trimethyl-2-oxochromen-7-yl)oxyacetyl]amino]butanoic acid.
Chemical Property Profile of (S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid
Property Insights of (S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid
The XLogP value of 2.41956 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid. The TPSA of 105.84 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid. Following Lipinski's Rule of Five, (S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)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)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid?
The CAS number of (S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid is 956044-23-8.
What is the molecular formula of (S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid?
The molecular formula of (S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid is C19H23NO6S.
What is the molecular weight of (S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid?
The molecular weight of (S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid is 393.12 g/mol.
Where can I buy (S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid?
You can request a quote for (S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)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)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.