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Phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone
TL;DR: Phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone (CAS 354535-59-4) is a chemical compound with molecular formula C17H19N3O and molecular weight 281.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone
Also Known As: BAS 01041938, 1-benzoyl-4-(pyridin-4-ylmethyl)piperazine, phenyl 4-(4-pyridylmethyl)piperazinyl ketone, AB00098295-01, phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone
| Molecular Formula | C17H19N3O |
|---|---|
| Molecular Weight | 281.15 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 36.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.1528 |
| Heavy Atoms | 21 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 354535-59-4 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=NC=C2)C(=O)C3=CC=CC=C3 |
| InChIKey | NDVKDAUCCSMJKV-UHFFFAOYSA-N |
Product Overview
Phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone (CAS 354535-59-4), with molecular formula C17H19N3O and molecular weight 281.15 g/mol. IUPAC: phenyl-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone.
Chemical Property Profile of Phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone
Property Insights of Phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone. With a topological polar surface area (TPSA) of 36.4 Ų, Phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone has 0 hydrogen bond donor(s) and 3 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 Phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone?
The CAS number of Phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone is 354535-59-4.
What is the molecular formula of Phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone?
The molecular formula of Phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone is C17H19N3O.
What is the molecular weight of Phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone?
The molecular weight of Phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone is 281.15 g/mol.
Where can I buy Phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone?
You can request a quote for Phenyl[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 Phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone?
Yes, KEHONG BIO provides custom synthesis services for Phenyl[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.