![N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine structure](/static/products/956/956962-69-9.png)
N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine
TL;DR: N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine (CAS 956962-69-9) is a chemical compound with molecular formula C21H25NO6 and molecular weight 387.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[2-[4,8-dimethyl-7-(3-methylbut-2-enoxy)-2-oxochromen-3-yl]acetyl]amino]propanoic acid
Also Known As: N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine, (2S)-2-[[2-[4,8-dimethyl-7-(3-methylbut-2-enoxy)-2-oxo-chromen-3-yl]acetyl]amino]propanoic Acid, (2S)-2-[[2-[4,8-dimethyl-7-(3-methylbut-2-enoxy)-2-oxochromen-3-yl]acetyl]amino]propanoic acid, (S)-2-(2-(4,8-dimethyl-7-((3-methylbut-2-en-1-yl)oxy)-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid
| Molecular Formula | C21H25NO6 |
|---|---|
| Molecular Weight | 387.17 g/mol |
| LogP | 2.88664 |
| Topological Polar Surface Area | 105.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 387.16818 |
| Heavy Atoms | 28 |
| Complexity | 998.1034 |
Chemical Identifiers
| CAS Number | 956962-69-9 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC=C(C)C)CC(=O)N[C@@H](C)C(=O)O |
Product Overview
N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine (CAS 956962-69-9), with molecular formula C21H25NO6 and molecular weight 387.17 g/mol. IUPAC: (2S)-2-[[2-[4,8-dimethyl-7-(3-methylbut-2-enoxy)-2-oxochromen-3-yl]acetyl]amino]propanoic acid.
Chemical Property Profile of N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine
Property Insights of N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine
The XLogP value of 2.88664 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine. The TPSA of 105.84 Ų falls within the moderate polarity range, balancing permeability and solubility for N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine. Following Lipinski's Rule of Five, N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine has 2 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 N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine?
The CAS number of N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine is 956962-69-9.
What is the molecular formula of N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine?
The molecular formula of N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine is C21H25NO6.
What is the molecular weight of N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine?
The molecular weight of N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine is 387.17 g/mol.
Where can I buy N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine?
You can request a quote for N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine?
Yes, KEHONG BIO provides custom synthesis services for N-({4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)-L-alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.