6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one
TL;DR: 6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one (CAS 921085-82-7) is a chemical compound with molecular formula C20H19ClN4O4 and molecular weight 414.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-4-methyl-7-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]chromen-2-one
Also Known As: 6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one, 6-chloro-4-methyl-7-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]chromen-2-one, 6-chloro-4-methyl-7-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethoxy}-2H-chromen-2-one
| Molecular Formula | C20H19ClN4O4 |
|---|---|
| Molecular Weight | 414.11 g/mol |
| LogP | 2.27242 |
| Topological Polar Surface Area | 88.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 414.1095 |
| Heavy Atoms | 29 |
| Complexity | 1094.8267 |
Chemical Identifiers
| CAS Number | 921085-82-7 |
|---|---|
| SMILES | CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)N3CCN(CC3)C4=NC=CC=N4 |
Product Overview
6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one (CAS 921085-82-7), with molecular formula C20H19ClN4O4 and molecular weight 414.11 g/mol. IUPAC: 6-chloro-4-methyl-7-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]chromen-2-one.
Chemical Property Profile of 6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one
Property Insights of 6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one
The XLogP value of 2.27242 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one. The TPSA of 88.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one. Following Lipinski's Rule of Five, 6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one 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 6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one?
The CAS number of 6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one is 921085-82-7.
What is the molecular formula of 6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one?
The molecular formula of 6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one is C20H19ClN4O4.
What is the molecular weight of 6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one?
The molecular weight of 6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one is 414.11 g/mol.
Where can I buy 6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one?
You can request a quote for 6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-chloro-4-methyl-7-(2-oxo-2-(4-(pyrimidin-2-yl)piperazin-1-yl)ethoxy)-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.