![6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one structure](/static/products/896/896830-67-4.png)
6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one
TL;DR: 6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one (CAS 896830-67-4) is a chemical compound with molecular formula C16H19ClN2O2 and molecular weight 306.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]chromen-2-one
Also Known As: 6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one, 6-chloro-4-((4-ethylpiperazin-1-yl)methyl)-2H-chromen-2-one, 6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]chromen-2-one, 6-chloro-4-[(4-ethylpiperazinyl)methyl]chromen-2-one
| Molecular Formula | C16H19ClN2O2 |
|---|---|
| Molecular Weight | 306.11 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 306.1135 |
| Heavy Atoms | 21 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 896830-67-4 |
|---|---|
| SMILES | CCN1CCN(CC1)CC2=CC(=O)OC3=C2C=C(C=C3)Cl |
| InChIKey | RGMHQYBQSMZQDI-UHFFFAOYSA-N |
Product Overview
6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one (CAS 896830-67-4), with molecular formula C16H19ClN2O2 and molecular weight 306.11 g/mol. IUPAC: 6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]chromen-2-one.
Chemical Property Profile of 6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one
Property Insights of 6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one. With a topological polar surface area (TPSA) of 32.8 Ų, 6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one has 0 hydrogen bond donor(s) and 4 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-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one?
The CAS number of 6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one is 896830-67-4.
What is the molecular formula of 6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one?
The molecular formula of 6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one is C16H19ClN2O2.
What is the molecular weight of 6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one?
The molecular weight of 6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one is 306.11 g/mol.
Where can I buy 6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one?
You can request a quote for 6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-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-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-chloro-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.