(2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone
TL;DR: (2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone (CAS 354535-96-9) is a chemical compound with molecular formula C17H18FN3O and molecular weight 299.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone
Also Known As: BAS 01042016, 2-fluorophenyl 4-(4-pyridylmethyl)piperazinyl ketone, (2-fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone, 1-(2-FLUOROBENZOYL)-4-(PYRIDIN-4-YLMETHYL)PIPERAZINE, 1-[(2-fluorophenyl)carbonyl]-4-(pyridin-4-ylmethyl)piperazine
| Molecular Formula | C17H18FN3O |
|---|---|
| Molecular Weight | 299.14 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 36.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.1434 |
| Heavy Atoms | 22 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 354535-96-9 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=NC=C2)C(=O)C3=CC=CC=C3F |
| InChIKey | GNUDCVQYEOVXAF-UHFFFAOYSA-N |
Product Overview
(2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone (CAS 354535-96-9), with molecular formula C17H18FN3O and molecular weight 299.14 g/mol. IUPAC: (2-fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone.
Chemical Property Profile of (2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone
Property Insights of (2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone. With a topological polar surface area (TPSA) of 36.4 Ų, (2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-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 (2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone?
The CAS number of (2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone is 354535-96-9.
What is the molecular formula of (2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone?
The molecular formula of (2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone is C17H18FN3O.
What is the molecular weight of (2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone?
The molecular weight of (2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone is 299.14 g/mol.
Where can I buy (2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone?
You can request a quote for (2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone?
Yes, KEHONG BIO provides custom synthesis services for (2-Fluorophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.