![(S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid structure](/static/products/956/956683-72-0.png)
(S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid
TL;DR: (S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid (CAS 956683-72-0) is a chemical compound with molecular formula C27H27NO6S and molecular weight 493.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-4-methylsulfanyl-2-[[2-(2,5,9-trimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)acetyl]amino]butanoic acid
Also Known As: (S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid, N-[(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetyl]-L-methionine, (2S)-4-methylsulfanyl-2-[[2-(2,5,9-trimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)acetyl]amino]butanoic acid
| Molecular Formula | C27H27NO6S |
|---|---|
| Molecular Weight | 493.16 g/mol |
| LogP | 4.99646 |
| Topological Polar Surface Area | 109.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 493.1559 |
| Heavy Atoms | 35 |
| Complexity | 1485.1085 |
Chemical Identifiers
| CAS Number | 956683-72-0 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C(C3=C(C=C12)C(=C(O3)C)C4=CC=CC=C4)C)CC(=O)N[C@@H](CCSC)C(=O)O |
Product Overview
(S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid (CAS 956683-72-0), with molecular formula C27H27NO6S and molecular weight 493.16 g/mol. IUPAC: (2S)-4-methylsulfanyl-2-[[2-(2,5,9-trimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)acetyl]amino]butanoic acid.
Chemical Property Profile of (S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid
Property Insights of (S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid
The XLogP value of 4.99646 indicates that (S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.75 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid. Following Lipinski's Rule of Five, (S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)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-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid?
The CAS number of (S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid is 956683-72-0.
What is the molecular formula of (S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid?
The molecular formula of (S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid is C27H27NO6S.
What is the molecular weight of (S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid?
The molecular weight of (S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid is 493.16 g/mol.
Where can I buy (S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid?
You can request a quote for (S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)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-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-4-(methylthio)-2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.