6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one
TL;DR: 6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one (CAS 902319-99-7) is a chemical compound with molecular formula C22H21ClN2O4 and molecular weight 412.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-7-hydroxy-4-methyl-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]chromen-2-one
Also Known As: 6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one, 6-chloro-7-hydroxy-4-methyl-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2H-chromen-2-one, 6-chloro-7-hydroxy-4-methyl-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]chromen-2-one
| Molecular Formula | C22H21ClN2O4 |
|---|---|
| Molecular Weight | 412.12 g/mol |
| LogP | 3.35172 |
| Topological Polar Surface Area | 73.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 412.119 |
| Heavy Atoms | 29 |
| Complexity | 1119.1007 |
Chemical Identifiers
| CAS Number | 902319-99-7 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)O)CC(=O)N3CCN(CC3)C4=CC=CC=C4 |
Product Overview
6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one (CAS 902319-99-7), with molecular formula C22H21ClN2O4 and molecular weight 412.12 g/mol. IUPAC: 6-chloro-7-hydroxy-4-methyl-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]chromen-2-one.
Chemical Property Profile of 6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one
Property Insights of 6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one
The XLogP value of 3.35172 indicates that 6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one. Following Lipinski's Rule of Five, 6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one 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 6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one?
The CAS number of 6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one is 902319-99-7.
What is the molecular formula of 6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one?
The molecular formula of 6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one is C22H21ClN2O4.
What is the molecular weight of 6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one?
The molecular weight of 6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one is 412.12 g/mol.
Where can I buy 6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one?
You can request a quote for 6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-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-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-chloro-7-hydroxy-4-methyl-3-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.