1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine
TL;DR: 1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine (CAS 333757-61-2) is a chemical compound with molecular formula C20H21FN2O4 and molecular weight 372.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,3-dimethoxyphenyl)-[4-(2-fluorobenzoyl)piperazin-1-yl]methanone
Also Known As: BAS 03050112, 1-(2,3-dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine, AT-057/43313914, (2,3-dimethoxyphenyl)-[4-(2-fluorobenzoyl)piperazin-1-yl]methanone, (2,3-Dimethoxy-phenyl)-[4-(2-fluoro-benzoyl)-piperazin-1-yl]-methanone
| Molecular Formula | C20H21FN2O4 |
|---|---|
| Molecular Weight | 372.15 g/mol |
| LogP | 2.4411 |
| Topological Polar Surface Area | 59.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 372.14853 |
| Heavy Atoms | 27 |
| Complexity | 847.6254 |
Chemical Identifiers
| CAS Number | 333757-61-2 |
|---|---|
| SMILES | COC1=CC=CC(=C1OC)C(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3F |
Product Overview
1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine (CAS 333757-61-2), with molecular formula C20H21FN2O4 and molecular weight 372.15 g/mol. IUPAC: (2,3-dimethoxyphenyl)-[4-(2-fluorobenzoyl)piperazin-1-yl]methanone.
Chemical Property Profile of 1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine
Property Insights of 1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine
The XLogP value of 2.4411 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine. With a topological polar surface area (TPSA) of 59.08 Ų, 1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine 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 1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine?
The CAS number of 1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine is 333757-61-2.
What is the molecular formula of 1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine?
The molecular formula of 1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine is C20H21FN2O4.
What is the molecular weight of 1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine?
The molecular weight of 1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine is 372.15 g/mol.
Where can I buy 1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine?
You can request a quote for 1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,3-Dimethoxybenzoyl)-4-(2-fluorobenzoyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.