(S)-2-(2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid
TL;DR: (S)-2-(2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid (CAS 956626-95-2) is a chemical compound with molecular formula C22H21NO6 and molecular weight 395.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[2-(7-hydroxy-4,8-dimethyl-2-oxochromen-3-yl)acetyl]amino]-3-phenylpropanoic acid
Also Known As: (S)-2-(2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid, (2S)-2-[[2-(7-hydroxy-4,8-dimethyl-2-oxochromen-3-yl)acetyl]amino]-3-phenylpropanoic acid, 2-[[2-(7-hydroxy-4,8-dimethyl-2-oxo-chromen-3-yl)acetyl]amino]-3-phenyl-propanoic Acid
| Molecular Formula | C22H21NO6 |
|---|---|
| Molecular Weight | 395.14 g/mol |
| LogP | 2.47004 |
| Topological Polar Surface Area | 116.84 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 395.1369 |
| Heavy Atoms | 29 |
| Complexity | 1133.4879 |
Chemical Identifiers
| CAS Number | 956626-95-2 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CC(=O)N[C@@H](CC3=CC=CC=C3)C(=O)O |
Product Overview
(S)-2-(2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid (CAS 956626-95-2), with molecular formula C22H21NO6 and molecular weight 395.14 g/mol. IUPAC: (2S)-2-[[2-(7-hydroxy-4,8-dimethyl-2-oxochromen-3-yl)acetyl]amino]-3-phenylpropanoic acid.
Chemical Property Profile of (S)-2-(2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid
Property Insights of (S)-2-(2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid
The XLogP value of 2.47004 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-(2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid. The TPSA of 116.84 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-(2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid. Following Lipinski's Rule of Five, (S)-2-(2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid has 3 hydrogen bond donor(s) and 5 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-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid?
The CAS number of (S)-2-(2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid is 956626-95-2.
What is the molecular formula of (S)-2-(2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid?
The molecular formula of (S)-2-(2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid is C22H21NO6.
What is the molecular weight of (S)-2-(2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid?
The molecular weight of (S)-2-(2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid is 395.14 g/mol.
Where can I buy (S)-2-(2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid?
You can request a quote for (S)-2-(2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic 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-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-(2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamido)-3-phenylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.