![(S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid structure](/static/products/956/956041-02-4.png)
(S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid
TL;DR: (S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid (CAS 956041-02-4) is a chemical compound with molecular formula C28H29NO6S and molecular weight 507.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-4-methylsulfanyl-2-[3-(2,5,9-trimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)propanoylamino]butanoic acid
Also Known As: (S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid, N-[3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanoyl]-L-methionine, (2S)-4-methylsulfanyl-2-[3-(2,5,9-trimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)propanoylamino]butanoic acid
| Molecular Formula | C28H29NO6S |
|---|---|
| Molecular Weight | 507.17 g/mol |
| LogP | 5.38656 |
| Topological Polar Surface Area | 109.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 507.17157 |
| Heavy Atoms | 36 |
| Complexity | 1502.0312 |
Chemical Identifiers
| CAS Number | 956041-02-4 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C(C3=C(C=C12)C(=C(O3)C)C4=CC=CC=C4)C)CCC(=O)N[C@@H](CCSC)C(=O)O |
Product Overview
(S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid (CAS 956041-02-4), with molecular formula C28H29NO6S and molecular weight 507.17 g/mol. IUPAC: (2S)-4-methylsulfanyl-2-[3-(2,5,9-trimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)propanoylamino]butanoic acid.
Chemical Property Profile of (S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid
Property Insights of (S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid
The XLogP value of 5.38656 indicates that (S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)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-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid. Following Lipinski's Rule of Five, (S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid?
The CAS number of (S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid is 956041-02-4.
What is the molecular formula of (S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid?
The molecular formula of (S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid is C28H29NO6S.
What is the molecular weight of (S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid?
The molecular weight of (S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid is 507.17 g/mol.
Where can I buy (S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid?
You can request a quote for (S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)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-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-4-(methylthio)-2-(3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.