methanone structure](/static/products/4449/444907-78-2.webp)
[4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone
TL;DR: [4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone (CAS 444907-78-2) is a chemical compound with molecular formula C18H21N3O and molecular weight 295.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(3-methylphenyl)methyl]piperazin-1-yl]-pyridin-3-ylmethanone
Also Known As: BAS 02500730, [4-(3-methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone, [4-[(3-methylphenyl)methyl]piperazin-1-yl]-pyridin-3-ylmethanone, [4-(3-Methyl-benzyl)-piperazin-1-yl]-pyridin-3-yl-methanone, 1-[(3-METHYLPHENYL)METHYL]-4-(PYRIDINE-3-CARBONYL)PIPERAZINE
| Molecular Formula | C18H21N3O |
|---|---|
| Molecular Weight | 295.17 g/mol |
| LogP | 2.34802 |
| Topological Polar Surface Area | 36.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.16846 |
| Heavy Atoms | 22 |
| Complexity | 633.79034 |
Chemical Identifiers
| CAS Number | 444907-78-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3=CN=CC=C3 |
Product Overview
[4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone (CAS 444907-78-2), with molecular formula C18H21N3O and molecular weight 295.17 g/mol. IUPAC: [4-[(3-methylphenyl)methyl]piperazin-1-yl]-pyridin-3-ylmethanone.
Chemical Property Profile of [4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone
Property Insights of [4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone
The XLogP value of 2.34802 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone. With a topological polar surface area (TPSA) of 36.44 Ų, [4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-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 [4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone?
The CAS number of [4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone is 444907-78-2.
What is the molecular formula of [4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone?
The molecular formula of [4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone is C18H21N3O.
What is the molecular weight of [4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone?
The molecular weight of [4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone is 295.17 g/mol.
Where can I buy [4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone?
You can request a quote for [4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for [4-(3-Methylbenzyl)piperazin-1-yl](pyridin-3-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.