![(2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone structure](/static/products/838/838818-01-2.png)
(2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone
TL;DR: (2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone (CAS 838818-01-2) is a chemical compound with molecular formula C23H23ClN4O2S and molecular weight 454.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone
Also Known As: (2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone, (2-benzylsulfanyl-5-chloro-pyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone, [2-(benzylsulfanyl)-5-chloropyrimidin-4-yl][4-(4-methoxyphenyl)piperazin-1-yl]methanone
| Molecular Formula | C23H23ClN4O2S |
|---|---|
| Molecular Weight | 454.12 g/mol |
| LogP | 4.3933 |
| Topological Polar Surface Area | 58.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 454.12302 |
| Heavy Atoms | 31 |
| Complexity | 1025.5062 |
Chemical Identifiers
| CAS Number | 838818-01-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=NC(=NC=C3Cl)SCC4=CC=CC=C4 |
Product Overview
(2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone (CAS 838818-01-2), with molecular formula C23H23ClN4O2S and molecular weight 454.12 g/mol. IUPAC: (2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone.
Chemical Property Profile of (2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone
Property Insights of (2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone
The XLogP value of 4.3933 indicates that (2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.56 Ų, (2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone has 0 hydrogen bond donor(s) and 6 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-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone?
The CAS number of (2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone is 838818-01-2.
What is the molecular formula of (2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone?
The molecular formula of (2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone is C23H23ClN4O2S.
What is the molecular weight of (2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone?
The molecular weight of (2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone is 454.12 g/mol.
Where can I buy (2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone?
You can request a quote for (2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)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-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone?
Yes, KEHONG BIO provides custom synthesis services for (2-benzylsulfanyl-5-chloropyrimidin-4-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.