N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine
TL;DR: N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine (CAS 956324-20-2) is a chemical compound with molecular formula C20H25NO6 and molecular weight 375.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-methyl-2-[[2-(8-methyl-2-oxo-4-propylchromen-7-yl)oxyacetyl]amino]butanoic acid
Also Known As: EiM07-16904, AO-022/43453783, N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine, (2S)-3-methyl-2-[[2-(8-methyl-2-oxo-4-propylchromen-7-yl)oxyacetyl]amino]butanoic acid, (S)-3-methyl-2-(2-((8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy)acetamido)butanoic acid
| Molecular Formula | C20H25NO6 |
|---|---|
| Molecular Weight | 375.17 g/mol |
| LogP | 2.65812 |
| Topological Polar Surface Area | 105.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 375.16818 |
| Heavy Atoms | 27 |
| Complexity | 899.21545 |
Chemical Identifiers
| CAS Number | 956324-20-2 |
|---|---|
| SMILES | CCCC1=CC(=O)OC2=C1C=CC(=C2C)OCC(=O)N[C@@H](C(C)C)C(=O)O |
Product Overview
N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine (CAS 956324-20-2), with molecular formula C20H25NO6 and molecular weight 375.17 g/mol. IUPAC: (2S)-3-methyl-2-[[2-(8-methyl-2-oxo-4-propylchromen-7-yl)oxyacetyl]amino]butanoic acid.
Chemical Property Profile of N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine
Property Insights of N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine
The XLogP value of 2.65812 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine. The TPSA of 105.84 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine. Following Lipinski's Rule of Five, N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine 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-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine?
The CAS number of N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine is 956324-20-2.
What is the molecular formula of N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine?
The molecular formula of N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine is C20H25NO6.
What is the molecular weight of N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine?
The molecular weight of N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine is 375.17 g/mol.
Where can I buy N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine?
You can request a quote for N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine?
Yes, KEHONG BIO provides custom synthesis services for N-{[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetyl}valine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.