6-ethyl-4-((4-ethylpiperazin-1-yl)methyl)-2H-chromen-2-one
TL;DR: 6-ethyl-4-((4-ethylpiperazin-1-yl)methyl)-2H-chromen-2-one (CAS 896830-15-2) is a chemical compound with molecular formula C18H24N2O2 and molecular weight 300.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-ethyl-4-[(4-ethylpiperazin-1-yl)methyl]chromen-2-one
Also Known As: 6-ethyl-4-((4-ethylpiperazin-1-yl)methyl)-2H-chromen-2-one, 6-ethyl-4-[(4-ethylpiperazin-1-yl)methyl]chromen-2-one, AB01289418-01, 6-ethyl-4-[(4-ethylpiperazin-1-yl)methyl]-2H-chromen-2-one, 6-ethyl-4-[(4-ethylpiperazinyl)methyl]chromen-2-one
| Molecular Formula | C18H24N2O2 |
|---|---|
| Molecular Weight | 300.18 g/mol |
| LogP | 2.4929 |
| Topological Polar Surface Area | 36.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.18378 |
| Heavy Atoms | 22 |
| Complexity | 699.7896 |
Chemical Identifiers
| CAS Number | 896830-15-2 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(CC3)CC |
Product Overview
6-ethyl-4-((4-ethylpiperazin-1-yl)methyl)-2H-chromen-2-one (CAS 896830-15-2), with molecular formula C18H24N2O2 and molecular weight 300.18 g/mol. IUPAC: 6-ethyl-4-[(4-ethylpiperazin-1-yl)methyl]chromen-2-one.
Chemical Property Profile of 6-ethyl-4-((4-ethylpiperazin-1-yl)methyl)-2H-chromen-2-one
Property Insights of 6-ethyl-4-((4-ethylpiperazin-1-yl)methyl)-2H-chromen-2-one
The XLogP value of 2.4929 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-ethyl-4-((4-ethylpiperazin-1-yl)methyl)-2H-chromen-2-one. With a topological polar surface area (TPSA) of 36.69 Ų, 6-ethyl-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-ethyl-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-ethyl-4-((4-ethylpiperazin-1-yl)methyl)-2H-chromen-2-one?
The CAS number of 6-ethyl-4-((4-ethylpiperazin-1-yl)methyl)-2H-chromen-2-one is 896830-15-2.
What is the molecular formula of 6-ethyl-4-((4-ethylpiperazin-1-yl)methyl)-2H-chromen-2-one?
The molecular formula of 6-ethyl-4-((4-ethylpiperazin-1-yl)methyl)-2H-chromen-2-one is C18H24N2O2.
What is the molecular weight of 6-ethyl-4-((4-ethylpiperazin-1-yl)methyl)-2H-chromen-2-one?
The molecular weight of 6-ethyl-4-((4-ethylpiperazin-1-yl)methyl)-2H-chromen-2-one is 300.18 g/mol.
Where can I buy 6-ethyl-4-((4-ethylpiperazin-1-yl)methyl)-2H-chromen-2-one?
You can request a quote for 6-ethyl-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-ethyl-4-((4-ethylpiperazin-1-yl)methyl)-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-ethyl-4-((4-ethylpiperazin-1-yl)methyl)-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.