N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide
TL;DR: N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide (CAS 87587-15-3) is a chemical compound with molecular formula C12H18N4OS and molecular weight 266.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[1-(1-oxidopyridin-1-ium-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide
Also Known As: N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide, N'-[1-(1-oxidopyridin-1-ium-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide
| Molecular Formula | C12H18N4OS |
|---|---|
| Molecular Weight | 266.12 g/mol |
| LogP | 0.8559 |
| Topological Polar Surface Area | 54.24 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.12012 |
| Heavy Atoms | 18 |
| Complexity | 420.29337 |
Chemical Identifiers
| CAS Number | 87587-15-3 |
|---|---|
| SMILES | CC(C1=CC=CC=[N+]1[O-])NNC(=S)N2CCCC2 |
Product Overview
N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide (CAS 87587-15-3), with molecular formula C12H18N4OS and molecular weight 266.12 g/mol. IUPAC: N'-[1-(1-oxidopyridin-1-ium-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide.
Chemical Property Profile of N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide
Property Insights of N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide
The XLogP value of 0.8559 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide. With a topological polar surface area (TPSA) of 54.24 Ų, N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide has 2 hydrogen bond donor(s) and 3 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'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide?
The CAS number of N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide is 87587-15-3.
What is the molecular formula of N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide?
The molecular formula of N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide is C12H18N4OS.
What is the molecular weight of N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide?
The molecular weight of N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide is 266.12 g/mol.
Where can I buy N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide?
You can request a quote for N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide?
Yes, KEHONG BIO provides custom synthesis services for N'-[1-(1-Oxo-1lambda~5~-pyridin-2-yl)ethyl]pyrrolidine-1-carbothiohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.