![3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one structure](/static/products/207/207385-92-0.png)
3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one
TL;DR: 3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one (CAS 207385-92-0) is a chemical compound with molecular formula C13H13BrN2O2 and molecular weight 308.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(4-bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one
Also Known As: AQ-149/41813173, 3-[2-(4-bromophenyl)-2-oxoethylidene]-6-methyl-2-piperazinone, 3-[2-(4-bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one
| Molecular Formula | C13H13BrN2O2 |
|---|---|
| Molecular Weight | 308.02 g/mol |
| LogP | 1.6236 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 308.01605 |
| Heavy Atoms | 18 |
| Complexity | 508.22745 |
Chemical Identifiers
| CAS Number | 207385-92-0 |
|---|---|
| SMILES | CC1CNC(=CC(=O)C2=CC=C(C=C2)Br)C(=O)N1 |
Product Overview
3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one (CAS 207385-92-0), with molecular formula C13H13BrN2O2 and molecular weight 308.02 g/mol. IUPAC: 3-[2-(4-bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one.
Chemical Property Profile of 3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one
Property Insights of 3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one
The XLogP value of 1.6236 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one. With a topological polar surface area (TPSA) of 58.2 Ų, 3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one has 2 hydrogen bond donor(s) and 3 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 3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one?
The CAS number of 3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one is 207385-92-0.
What is the molecular formula of 3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one?
The molecular formula of 3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one is C13H13BrN2O2.
What is the molecular weight of 3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one?
The molecular weight of 3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one is 308.02 g/mol.
Where can I buy 3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one?
You can request a quote for 3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(4-Bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.