(R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid
TL;DR: (R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid (CAS 956041-93-3) is a chemical compound with molecular formula C24H25NO7S and molecular weight 471.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-3-benzylsulfanyl-2-[[2-(6,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid
Also Known As: (R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid, S-benzyl-N-[(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-L-cysteine, (2R)-3-benzylsulfanyl-2-[[2-(6,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid
| Molecular Formula | C24H25NO7S |
|---|---|
| Molecular Weight | 471.14 g/mol |
| LogP | 3.16392 |
| Topological Polar Surface Area | 115.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 471.13516 |
| Heavy Atoms | 33 |
| Complexity | 1206.8986 |
Chemical Identifiers
| CAS Number | 956041-93-3 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=CC(=C(C=C12)OC)OC)CC(=O)N[C@@H](CSCC3=CC=CC=C3)C(=O)O |
Product Overview
(R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid (CAS 956041-93-3), with molecular formula C24H25NO7S and molecular weight 471.14 g/mol. IUPAC: (2R)-3-benzylsulfanyl-2-[[2-(6,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid.
Chemical Property Profile of (R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid
Property Insights of (R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid
The XLogP value of 3.16392 indicates that (R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.07 Ų falls within the moderate polarity range, balancing permeability and solubility for (R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid. Following Lipinski's Rule of Five, (R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid has 2 hydrogen bond donor(s) and 7 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 (R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid?
The CAS number of (R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid is 956041-93-3.
What is the molecular formula of (R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid?
The molecular formula of (R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid is C24H25NO7S.
What is the molecular weight of (R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid?
The molecular weight of (R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid is 471.14 g/mol.
Where can I buy (R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid?
You can request a quote for (R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.