![2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline structure](/static/products/871/871550-45-7.png)
2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline
TL;DR: 2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline (CAS 871550-45-7) is a chemical compound with molecular formula C18H16ClN5O and molecular weight 353.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chloroquinolin-4-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
Also Known As: 2-chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline, (2-chloroquinolin-4-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
| Molecular Formula | C18H16ClN5O |
|---|---|
| Molecular Weight | 353.10 g/mol |
| LogP | 2.6406 |
| Topological Polar Surface Area | 62.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 353.10434 |
| Heavy Atoms | 25 |
| Complexity | 909.7433 |
Chemical Identifiers
| CAS Number | 871550-45-7 |
|---|---|
| SMILES | C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC(=NC4=CC=CC=C43)Cl |
Product Overview
2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline (CAS 871550-45-7), with molecular formula C18H16ClN5O and molecular weight 353.10 g/mol. IUPAC: (2-chloroquinolin-4-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone.
Chemical Property Profile of 2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline
Property Insights of 2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline
The XLogP value of 2.6406 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline. The TPSA of 62.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline. Following Lipinski's Rule of Five, 2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline 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 2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline?
The CAS number of 2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline is 871550-45-7.
What is the molecular formula of 2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline?
The molecular formula of 2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline is C18H16ClN5O.
What is the molecular weight of 2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline?
The molecular weight of 2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline is 353.10 g/mol.
Where can I buy 2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline?
You can request a quote for 2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.