Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate
TL;DR: Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate (CAS 673497-79-5) is a chemical compound with molecular formula C21H19NO7 and molecular weight 397.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate
Also Known As: EiM07-16598, methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate, methyl {4,8-dimethyl-7-[(4-nitrobenzyl)oxy]-2-oxo-2H-chromen-3-yl}acetate, methyl 2-(4,8-dimethyl-7-((4-nitrobenzyl)oxy)-2-oxo-2H-chromen-3-yl)acetate, METHYL 2-{4,8-DIMETHYL-7-[(4-NITROPHENYL)METHOXY]-2-OXO-2H-CHROMEN-3-YL}ACETATE
| Molecular Formula | C21H19NO7 |
|---|---|
| Molecular Weight | 397.12 g/mol |
| LogP | 3.61254 |
| Topological Polar Surface Area | 108.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 397.11615 |
| Heavy Atoms | 29 |
| Complexity | 1146.3887 |
Chemical Identifiers
| CAS Number | 673497-79-5 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC3=CC=C(C=C3)[N+](=O)[O-])CC(=O)OC |
Product Overview
Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate (CAS 673497-79-5), with molecular formula C21H19NO7 and molecular weight 397.12 g/mol. IUPAC: methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate.
Chemical Property Profile of Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate
Property Insights of Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate
The XLogP value of 3.61254 indicates that Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.88 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate. Following Lipinski's Rule of Five, Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate has 0 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 Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate?
The CAS number of Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate is 673497-79-5.
What is the molecular formula of Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate?
The molecular formula of Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate is C21H19NO7.
What is the molecular weight of Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate?
The molecular weight of Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate is 397.12 g/mol.
Where can I buy Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate?
You can request a quote for Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[4,8-dimethyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.