![N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide structure](/static/products/875/87555-59-7.png)
N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide
TL;DR: N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide (CAS 87555-59-7) is a chemical compound with molecular formula C20H26N4S and molecular weight 354.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide
Also Known As: N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide, N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-car, 3-Azabicyclo[3.2.2]nonane-3-thiocarboxylic acid 2-[1-[1-isoquinolyl]ethyl]hydrazide, N'-[1-(1-Isoquinolinyl)ethyl]-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide #, N'-[1-(Isoquinolin-1-yl)ethyl]-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide
| Molecular Formula | C20H26N4S |
|---|---|
| Molecular Weight | 354.19 g/mol |
| LogP | 3.7969 |
| Topological Polar Surface Area | 40.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 354.1878 |
| Heavy Atoms | 25 |
| Complexity | 734.94946 |
Chemical Identifiers
| CAS Number | 87555-59-7 |
|---|---|
| SMILES | CC(C1=NC=CC2=CC=CC=C21)NNC(=S)N3CC4CCC(C3)CC4 |
Product Overview
N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide (CAS 87555-59-7), with molecular formula C20H26N4S and molecular weight 354.19 g/mol. IUPAC: N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide.
Chemical Property Profile of N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide
Property Insights of N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide
The XLogP value of 3.7969 indicates that N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.19 Ų, N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-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-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide?
The CAS number of N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide is 87555-59-7.
What is the molecular formula of N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide?
The molecular formula of N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide is C20H26N4S.
What is the molecular weight of N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide?
The molecular weight of N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide is 354.19 g/mol.
Where can I buy N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide?
You can request a quote for N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-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-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide?
Yes, KEHONG BIO provides custom synthesis services for N'-(1-isoquinolin-1-ylethyl)-3-azabicyclo[3.2.2]nonane-3-carbothiohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.