1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene
TL;DR: 1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene (CAS 433702-97-7) is a chemical compound with molecular formula C16H17N3O2S and molecular weight 315.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-nitro-5-piperidin-1-ylphenyl)sulfanylpyridine
Also Known As: 1-nitro-4-piperidyl-2-(2-pyridylthio)benzene, 2-(2-nitro-5-piperidin-1-ylphenyl)sulfanylpyridine, 2-{[2-nitro-5-(piperidin-1-yl)phenyl]sulfanyl}pyridine, 1-[4-NITRO-3-(2-PYRIDYLSULFANYL)PHENYL]PIPERIDINE, A3084/0130483
| Molecular Formula | C16H17N3O2S |
|---|---|
| Molecular Weight | 315.10 g/mol |
| LogP | 4.1313 |
| Topological Polar Surface Area | 59.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.10416 |
| Heavy Atoms | 22 |
| Complexity | 657.69543 |
Chemical Identifiers
| CAS Number | 433702-97-7 |
|---|---|
| SMILES | C1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])SC3=CC=CC=N3 |
Product Overview
1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene (CAS 433702-97-7), with molecular formula C16H17N3O2S and molecular weight 315.10 g/mol. IUPAC: 2-(2-nitro-5-piperidin-1-ylphenyl)sulfanylpyridine.
Chemical Property Profile of 1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene
Property Insights of 1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene
The XLogP value of 4.1313 indicates that 1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.27 Ų, 1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene 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 1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene?
The CAS number of 1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene is 433702-97-7.
What is the molecular formula of 1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene?
The molecular formula of 1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene is C16H17N3O2S.
What is the molecular weight of 1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene?
The molecular weight of 1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene is 315.10 g/mol.
Where can I buy 1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene?
You can request a quote for 1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Nitro-4-piperidyl-2-(2-pyridylthio)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.