Mesylphenacyrazine
TL;DR: Mesylphenacyrazine (CAS 50648-51-6) is a chemical compound with molecular formula C23H26N2O7S and molecular weight 474.14606 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
but-2-enedioic acid;1-(4-methylsulfonylphenyl)-2-(4-phenylpiperazin-1-yl)ethanone
Also Known As: Mesylphenacyrazine, Mesylphenacyrazine maleate, 1-(4-Methanesulfonylphenacyl)-4-phenylpiperazine maleate, but-2-enedioic acid;1-(4-methylsulfonylphenyl)-2-(4-phenylpiperazin-1-yl)ethanone, Ethanone, 1-(4-(methylsulfonyl)phenyl)-2-(4-phenyl-1-piperazinyl)-, (Z)-2-butenedioate (1:1)
Technical Specifications
| Molecular Formula | C23H26N2O7S |
| Molecular Weight | 474.14606 g/mol |
| XLogP | 1.81 |
| Topological Polar Surface Area (TPSA) | 141.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 474.14606 Da |
| Heavy Atoms | 33 |
| Complexity | 654.0 |
| SMILES | CS(=O)(=O)C1=CC=C(C=C1)C(=O)CN2CCN(CC2)C3=CC=CC=C3.C(=CC(=O)O)C(=O)O |
| InChIKey | RHBIZMDAGBYZGV-UHFFFAOYSA-N |
Chemical Property Profile of Mesylphenacyrazine
Property Insights of Mesylphenacyrazine
The XLogP value of 1.81 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Mesylphenacyrazine. The TPSA of 141.0 Ų indicates high polarity, suggesting Mesylphenacyrazine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Mesylphenacyrazine has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Mesylphenacyrazine?
The CAS number of Mesylphenacyrazine is 50648-51-6.
What is the molecular formula of Mesylphenacyrazine?
The molecular formula of Mesylphenacyrazine is C23H26N2O7S.
What is the molecular weight of Mesylphenacyrazine?
The molecular weight of Mesylphenacyrazine is 474.14606 g/mol.
Where can I buy Mesylphenacyrazine?
You can request a quote for Mesylphenacyrazine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Mesylphenacyrazine?
Yes, CoreyChem provides custom synthesis services for Mesylphenacyrazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.