6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile
TL;DR: 6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile (CAS 381707-99-9) is a chemical compound with molecular formula C16H17N5O and molecular weight 295.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-methoxyphenyl)-2-piperazin-1-ylpyrimidine-4-carbonitrile
Also Known As: 6-(4-methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile, 6-(4-Methoxy-phenyl)-2-piperazin-1-yl-pyrimidine-4-carbonitrile, 6-(4-methoxyphenyl)-2-piperazin-1-ylpyrimidine-4-carbonitrile, 6-(4-methoxyphenyl)-2-piperazino-pyrimidine-4-carbonitrile, 6-(4-methoxyphenyl)-2-(1-piperazinyl)-4-pyrimidinecarbonitrile
| Molecular Formula | C16H17N5O |
|---|---|
| Molecular Weight | 295.14 g/mol |
| LogP | 1.43348 |
| Topological Polar Surface Area | 74.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.1433 |
| Heavy Atoms | 22 |
| Complexity | 686.6726 |
Chemical Identifiers
| CAS Number | 381707-99-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NC(=NC(=C2)C#N)N3CCNCC3 |
Product Overview
6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile (CAS 381707-99-9), with molecular formula C16H17N5O and molecular weight 295.14 g/mol. IUPAC: 6-(4-methoxyphenyl)-2-piperazin-1-ylpyrimidine-4-carbonitrile.
Chemical Property Profile of 6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile
Property Insights of 6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile
The XLogP value of 1.43348 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile. The TPSA of 74.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile. Following Lipinski's Rule of Five, 6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile 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 6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile?
The CAS number of 6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile is 381707-99-9.
What is the molecular formula of 6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile?
The molecular formula of 6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile is C16H17N5O.
What is the molecular weight of 6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile?
The molecular weight of 6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile is 295.14 g/mol.
Where can I buy 6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile?
You can request a quote for 6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-(4-Methoxyphenyl)-2-(piperazin-1-yl)pyrimidine-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.