N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide
TL;DR: N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide (CAS 904501-89-9) is a chemical compound with molecular formula C23H27N3O4 and molecular weight 409.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4,8-dimethyl-7-(2-methylprop-2-enoxy)-2-oxochromen-3-yl]-N-(3-imidazol-1-ylpropyl)acetamide
Also Known As: N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide, 2-[4,8-dimethyl-7-(2-methylprop-2-enoxy)-2-oxochromen-3-yl]-N-(3-imidazol-1-ylpropyl)acetamide, 2-{4,8-dimethyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}-N-[3-(1H-imidazol-1-yl)propyl]acetamide
| Molecular Formula | C23H27N3O4 |
|---|---|
| Molecular Weight | 409.20 g/mol |
| LogP | 3.31024 |
| Topological Polar Surface Area | 86.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 409.20016 |
| Heavy Atoms | 30 |
| Complexity | 1113.669 |
Chemical Identifiers
| CAS Number | 904501-89-9 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC(=C)C)CC(=O)NCCCN3C=CN=C3 |
Product Overview
N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide (CAS 904501-89-9), with molecular formula C23H27N3O4 and molecular weight 409.20 g/mol. IUPAC: 2-[4,8-dimethyl-7-(2-methylprop-2-enoxy)-2-oxochromen-3-yl]-N-(3-imidazol-1-ylpropyl)acetamide.
Chemical Property Profile of N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide
Property Insights of N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide
The XLogP value of 3.31024 indicates that N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.36 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide. Following Lipinski's Rule of Five, N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide has 1 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-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide?
The CAS number of N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide is 904501-89-9.
What is the molecular formula of N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide?
The molecular formula of N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide is C23H27N3O4.
What is the molecular weight of N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide?
The molecular weight of N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide is 409.20 g/mol.
Where can I buy N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide?
You can request a quote for N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-(1H-imidazol-1-yl)propyl)-2-(4,8-dimethyl-7-((2-methylallyl)oxy)-2-oxo-2H-chromen-3-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.