N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide
TL;DR: N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide (CAS 852664-21-2) is a chemical compound with molecular formula C17H17ClN6O and molecular weight 356.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-chloro-2-cyanophenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide
Also Known As: N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide, N-(5-chloro-2-cyano-phenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide, N-(5-chloro-2-cyanophenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide, N-(5-CHLORO-2-CYANOPHENYL)-2-[4-(PYRIMIDIN-2-YL)PIPERAZIN-1-YL]ACETAMIDE
| Molecular Formula | C17H17ClN6O |
|---|---|
| Molecular Weight | 356.12 g/mol |
| LogP | 1.76238 |
| Topological Polar Surface Area | 85.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.11523 |
| Heavy Atoms | 25 |
| Complexity | 783.4702 |
Chemical Identifiers
| CAS Number | 852664-21-2 |
|---|---|
| SMILES | C1CN(CCN1CC(=O)NC2=C(C=CC(=C2)Cl)C#N)C3=NC=CC=N3 |
Product Overview
N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide (CAS 852664-21-2), with molecular formula C17H17ClN6O and molecular weight 356.12 g/mol. IUPAC: N-(5-chloro-2-cyanophenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide.
Chemical Property Profile of N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide
Property Insights of N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide
The XLogP value of 1.76238 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide. The TPSA of 85.15 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide. Following Lipinski's Rule of Five, N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide has 1 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 N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide?
The CAS number of N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide is 852664-21-2.
What is the molecular formula of N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide?
The molecular formula of N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide is C17H17ClN6O.
What is the molecular weight of N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide?
The molecular weight of N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide is 356.12 g/mol.
Where can I buy N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide?
You can request a quote for N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-Chloro-2-cyanophenyl)-4-(2-pyrimidinyl)-1-piperazineacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.