(4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone
TL;DR: (4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone (CAS 420844-89-9) is a chemical compound with molecular formula C17H21N3O2 and molecular weight 299.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-ethylpiperazin-1-yl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone
Also Known As: BAS 03588505, 4-ethylpiperazinyl 5-methyl-3-phenylisoxazol-4-yl ketone, (4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone, (4-ethylpiperazin-1-yl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone, (4-ethylpiperazin-1-yl)(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone
| Molecular Formula | C17H21N3O2 |
|---|---|
| Molecular Weight | 299.16 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 49.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.1634 |
| Heavy Atoms | 22 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 420844-89-9 |
|---|---|
| SMILES | CCN1CCN(CC1)C(=O)C2=C(ON=C2C3=CC=CC=C3)C |
| InChIKey | ITEPPWPIXHBMLB-UHFFFAOYSA-N |
Product Overview
(4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone (CAS 420844-89-9), with molecular formula C17H21N3O2 and molecular weight 299.16 g/mol. IUPAC: (4-ethylpiperazin-1-yl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone.
Chemical Property Profile of (4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone
Property Insights of (4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone. With a topological polar surface area (TPSA) of 49.6 Ų, (4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone 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 (4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone?
The CAS number of (4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone is 420844-89-9.
What is the molecular formula of (4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone?
The molecular formula of (4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone is C17H21N3O2.
What is the molecular weight of (4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone?
The molecular weight of (4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone is 299.16 g/mol.
Where can I buy (4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone?
You can request a quote for (4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-Ethyl-piperazin-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)-methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.