1-Isonicotinoyl-4-(3-phenoxybenzyl)piperazine
TL;DR: 1-Isonicotinoyl-4-(3-phenoxybenzyl)piperazine (CAS 423744-90-5) is a chemical compound with molecular formula C23H23N3O2 and molecular weight 373.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(3-phenoxyphenyl)methyl]piperazin-1-yl]-pyridin-4-ylmethanone
Also Known As: BAS 02500428, 1-isonicotinoyl-4-(3-phenoxybenzyl)piperazine, BIM-0038377.P001, [4-[(3-phenoxyphenyl)methyl]piperazin-1-yl]-pyridin-4-ylmethanone, 4-[(3-phenoxyphenyl)methyl]piperazinyl 4-pyridyl ketone
| Molecular Formula | C23H23N3O2 |
|---|---|
| Molecular Weight | 373.18 g/mol |
| LogP | 3.8319 |
| Topological Polar Surface Area | 45.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.17902 |
| Heavy Atoms | 28 |
| Complexity | 907.40015 |
Chemical Identifiers
| CAS Number | 423744-90-5 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)C4=CC=NC=C4 |
Product Overview
1-Isonicotinoyl-4-(3-phenoxybenzyl)piperazine (CAS 423744-90-5), with molecular formula C23H23N3O2 and molecular weight 373.18 g/mol. IUPAC: [4-[(3-phenoxyphenyl)methyl]piperazin-1-yl]-pyridin-4-ylmethanone.
Chemical Property Profile of 1-Isonicotinoyl-4-(3-phenoxybenzyl)piperazine
Property Insights of 1-Isonicotinoyl-4-(3-phenoxybenzyl)piperazine
The XLogP value of 3.8319 indicates that 1-Isonicotinoyl-4-(3-phenoxybenzyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.67 Ų, 1-Isonicotinoyl-4-(3-phenoxybenzyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Isonicotinoyl-4-(3-phenoxybenzyl)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-Isonicotinoyl-4-(3-phenoxybenzyl)piperazine?
The CAS number of 1-Isonicotinoyl-4-(3-phenoxybenzyl)piperazine is 423744-90-5.
What is the molecular formula of 1-Isonicotinoyl-4-(3-phenoxybenzyl)piperazine?
The molecular formula of 1-Isonicotinoyl-4-(3-phenoxybenzyl)piperazine is C23H23N3O2.
What is the molecular weight of 1-Isonicotinoyl-4-(3-phenoxybenzyl)piperazine?
The molecular weight of 1-Isonicotinoyl-4-(3-phenoxybenzyl)piperazine is 373.18 g/mol.
Where can I buy 1-Isonicotinoyl-4-(3-phenoxybenzyl)piperazine?
You can request a quote for 1-Isonicotinoyl-4-(3-phenoxybenzyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Isonicotinoyl-4-(3-phenoxybenzyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-Isonicotinoyl-4-(3-phenoxybenzyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.