![N'-[1-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide structure](/static/products/834/83476-80-6.png)
N'-[1-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide
TL;DR: N'-[1-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide (CAS 83476-80-6) is a chemical compound with molecular formula C14H22N4S and molecular weight 278.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(1-pyridin-2-ylethyl)azepane-1-carbothiohydrazide
Also Known As: J1.019.990E, N'-[1-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide, N'-(1-pyridin-2-ylethyl)azepane-1-carbothiohydrazide, N'-[1-(2-Pyridinyl)ethyl]hexahydro-1H-azepine-1-carbothiohydrazide, N-{[1-(PYRIDIN-2-YL)ETHYL]AMINO}AZEPANE-1-CARBOTHIOAMIDE
| Molecular Formula | C14H22N4S |
|---|---|
| Molecular Weight | 278.16 g/mol |
| LogP | 2.3977 |
| Topological Polar Surface Area | 40.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.15652 |
| Heavy Atoms | 19 |
| Complexity | 387.69226 |
Chemical Identifiers
| CAS Number | 83476-80-6 |
|---|---|
| SMILES | CC(C1=CC=CC=N1)NNC(=S)N2CCCCCC2 |
Product Overview
N'-[1-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide (CAS 83476-80-6), with molecular formula C14H22N4S and molecular weight 278.16 g/mol. IUPAC: N'-(1-pyridin-2-ylethyl)azepane-1-carbothiohydrazide.
Chemical Property Profile of N'-[1-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide
Property Insights of N'-[1-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide
The XLogP value of 2.3977 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-[1-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide. With a topological polar surface area (TPSA) of 40.19 Ų, N'-[1-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N'-[1-(2-pyridyl)ethyl]azepane-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-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide?
The CAS number of N'-[1-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide is 83476-80-6.
What is the molecular formula of N'-[1-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide?
The molecular formula of N'-[1-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide is C14H22N4S.
What is the molecular weight of N'-[1-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide?
The molecular weight of N'-[1-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide is 278.16 g/mol.
Where can I buy N'-[1-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide?
You can request a quote for N'-[1-(2-pyridyl)ethyl]azepane-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-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide?
Yes, KEHONG BIO provides custom synthesis services for N'-[1-(2-pyridyl)ethyl]azepane-1-carbothiohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.