1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine
TL;DR: 1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine (CAS 433253-81-7) is a chemical compound with molecular formula C16H18N4O2S and molecular weight 330.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine
Also Known As: A3048/0128691, 1-methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine, 1-methyl-4-[4-nitro-3-(pyridin-2-ylsulfanyl)phenyl]piperazine, 1-methyl-4-(4-nitro-3-(pyridin-2-ylthio)phenyl)piperazine, 1-METHYL-4-[4-NITRO-3-(2-PYRIDYLSULFANYL)PHENYL]PIPERAZINE
| Molecular Formula | C16H18N4O2S |
|---|---|
| Molecular Weight | 330.12 g/mol |
| LogP | 2.8928 |
| Topological Polar Surface Area | 62.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.11505 |
| Heavy Atoms | 23 |
| Complexity | 687.7345 |
Chemical Identifiers
| CAS Number | 433253-81-7 |
|---|---|
| SMILES | CN1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])SC3=CC=CC=N3 |
Product Overview
1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine (CAS 433253-81-7), with molecular formula C16H18N4O2S and molecular weight 330.12 g/mol. IUPAC: 1-methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine.
Chemical Property Profile of 1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine
Property Insights of 1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine
The XLogP value of 2.8928 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine. The TPSA of 62.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine. Following Lipinski's Rule of Five, 1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine has 0 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 1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine?
The CAS number of 1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine is 433253-81-7.
What is the molecular formula of 1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine?
The molecular formula of 1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine is C16H18N4O2S.
What is the molecular weight of 1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine?
The molecular weight of 1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine is 330.12 g/mol.
Where can I buy 1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine?
You can request a quote for 1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.