N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine
TL;DR: N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine (CAS 305351-44-4) is a chemical compound with molecular formula C17H20N4S and molecular weight 312.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-(4-methylsulfanylphenyl)-N-(4-pyridin-2-ylpiperazin-1-yl)methanimine
Also Known As: 1-(4-methylsulfanylphenyl)-N-(4-pyridin-2-ylpiperazin-1-yl)methanimine, N-[4-(methylthio)benzylidene]-4-(2-pyridinyl)-1-piperazinamine, (E)-N-(4-(methylthio)benzylidene)-4-(pyridin-2-yl)piperazin-1-amine, N-(4-(METHYLTHIO)BENZYLIDENE)-4-(2-PYRIDINYL)-1-PIPERAZINAMINE, N-{(E)-[4-(methylsulfanyl)phenyl]methylidene}-4-(pyridin-2-yl)piperazin-1-amine
| Molecular Formula | C17H20N4S |
|---|---|
| Molecular Weight | 312.14 g/mol |
| LogP | 2.9596 |
| Topological Polar Surface Area | 31.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.14087 |
| Heavy Atoms | 22 |
| Complexity | 604.31586 |
Chemical Identifiers
| CAS Number | 305351-44-4 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)/C=N/N2CCN(CC2)C3=CC=CC=N3 |
Product Overview
N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine (CAS 305351-44-4), with molecular formula C17H20N4S and molecular weight 312.14 g/mol. IUPAC: (E)-1-(4-methylsulfanylphenyl)-N-(4-pyridin-2-ylpiperazin-1-yl)methanimine.
Chemical Property Profile of N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine
Property Insights of N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine
The XLogP value of 2.9596 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine. With a topological polar surface area (TPSA) of 31.73 Ų, N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine 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 N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine?
The CAS number of N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine is 305351-44-4.
What is the molecular formula of N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine?
The molecular formula of N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine is C17H20N4S.
What is the molecular weight of N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine?
The molecular weight of N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine is 312.14 g/mol.
Where can I buy N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine?
You can request a quote for N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine?
Yes, KEHONG BIO provides custom synthesis services for N-(4-(Methylthio)benzylidene)-4-(2-pyridinyl)-1-piperazinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.