2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one
TL;DR: 2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one (CAS 425634-97-5) is a chemical compound with molecular formula C10H13ClN4O and molecular weight 240.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone
Also Known As: 2-[4-(chloroacetyl)piperazin-1-yl]pyrimidine, Piperazine,1- -4- -, 2-chloro-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone, Piperazine, 1-(chloroacetyl)-4-(2-pyrimidinyl)- (9CI), 2-[4-(chloroacetyl)-1-piperazinyl]pyrimidine
| Molecular Formula | C10H13ClN4O |
|---|---|
| Molecular Weight | 240.08 g/mol |
| LogP | 0.364 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.07779 |
| Heavy Atoms | 16 |
| Complexity | 351.09647 |
Chemical Identifiers
| CAS Number | 425634-97-5 |
|---|---|
| SMILES | C1CN(CCN1C2=NC=CC=N2)C(=O)CCl |
Product Overview
2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one (CAS 425634-97-5), with molecular formula C10H13ClN4O and molecular weight 240.08 g/mol. IUPAC: 2-chloro-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone.
Chemical Property Profile of 2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one
Property Insights of 2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one
The XLogP value of 0.364 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one. With a topological polar surface area (TPSA) of 49.33 Ų, 2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one 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 2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one?
The CAS number of 2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one is 425634-97-5.
What is the molecular formula of 2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one?
The molecular formula of 2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one is C10H13ClN4O.
What is the molecular weight of 2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one?
The molecular weight of 2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one is 240.08 g/mol.
Where can I buy 2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one?
You can request a quote for 2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-1-(4-(pyrimidin-2-yl)piperazin-1-yl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.