1-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone
TL;DR: 1-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone (CAS 701237-71-0) is a chemical compound with molecular formula C24H26N4OS and molecular weight 418.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone
Also Known As: 1-(4-benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone, 2-({2-[4-(diphenylmethyl)-1-piperazinyl]-2-oxoethyl}thio)-4-methylpyrimidine
| Molecular Formula | C24H26N4OS |
|---|---|
| Molecular Weight | 418.18 g/mol |
| LogP | 3.81092 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.18274 |
| Heavy Atoms | 30 |
| Complexity | 919.70953 |
Chemical Identifiers
| CAS Number | 701237-71-0 |
|---|---|
| SMILES | CC1=NC(=NC=C1)SCC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4 |
Product Overview
1-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone (CAS 701237-71-0), with molecular formula C24H26N4OS and molecular weight 418.18 g/mol. IUPAC: 1-(4-benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone.
Chemical Property Profile of 1-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone
Property Insights of 1-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone
The XLogP value of 3.81092 indicates that 1-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.33 Ų, 1-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone has 0 hydrogen bond donor(s) and 5 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-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone?
The CAS number of 1-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone is 701237-71-0.
What is the molecular formula of 1-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone?
The molecular formula of 1-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone is C24H26N4OS.
What is the molecular weight of 1-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone?
The molecular weight of 1-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone is 418.18 g/mol.
Where can I buy 1-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone?
You can request a quote for 1-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Benzhydrylpiperazin-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.