Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2)
TL;DR: Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2) (CAS 118989-76-7) is a chemical compound with molecular formula C21H27N3O9 and molecular weight 465.17474 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis((E)-but-2-enedioic acid);2-[4-(2-methylphenyl)piperazin-1-yl]acetamide
Also Known As: N-Phenyl-2-(4-methyl-1-piperazinyl)acetamide dimaleate, 1-Piperazineacetamide, 4-methyl-N-phenyl-, (Z)-2-butenedioate (1:2), Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2), 2-(4-Methyl-1-piperazinyl)-N-phenylacetamide (Z)-2-butenedioate (1:2), 1-Piperazineacetamide,4-methyl-N-phenyl-,(Z)-2-butenedioate(1:2)
Technical Specifications
| Molecular Formula | C21H27N3O9 |
| Molecular Weight | 465.17474 g/mol |
| XLogP | 0.02592 |
| Topological Polar Surface Area (TPSA) | 199.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 7 |
| Exact Mass | 465.17474 Da |
| Heavy Atoms | 33 |
| Complexity | 380.0 |
| SMILES | CC1=CC=CC=C1N2CCN(CC2)CC(=O)N.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O |
| InChIKey | MJDKIMXXGQERBL-LVEZLNDCSA-N |
Chemical Property Profile of Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2)
Property Insights of Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2)
The XLogP value of 0.02592 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2). The TPSA of 199.0 Ų indicates high polarity, suggesting Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2) has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2)?
The CAS number of Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2) is 118989-76-7.
What is the molecular formula of Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2)?
The molecular formula of Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2) is C21H27N3O9.
What is the molecular weight of Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2)?
The molecular weight of Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2) is 465.17474 g/mol.
Where can I buy Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2)?
You can request a quote for Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2)?
Yes, CoreyChem provides custom synthesis services for Acetamide, 2-(4-methyl-1-piperazinyl)-N-phenyl-, (Z)-2-butenedioate (1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.