![[1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone structure](/static/products/100/1005072-41-2.png)
[1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone
TL;DR: [1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone (CAS 1005072-41-2) is a chemical compound with molecular formula C24H32N2O2S and molecular weight 412.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[4-(diethylamino)phenyl]-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-thiophen-2-ylmethanone
Also Known As: [1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone|(1-(4-(diethylamino)phenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)(thiophen-2-yl)methanone|[1-[4-(diethylamino)phenyl]-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-thiophen-2-ylmethanone|{1-[4-(diethylamino)phenyl]-4a-hydroxyoctahydroisoquinolin-2(1H)-yl}(thiophen-2-yl)methanone|MLS000580321|SMR000220497
| Molecular Formula | C24H32N2O2S |
|---|---|
| Molecular Weight | 412.22 g/mol |
| LogP | 5.1028 |
| Topological Polar Surface Area | 43.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 412.21844 |
| Heavy Atoms | 29 |
| Complexity | 815.916 |
Chemical Identifiers
| CAS Number | 1005072-41-2 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)C2C3CCCCC3(CCN2C(=O)C4=CC=CS4)O |
Product Overview
[1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone (CAS 1005072-41-2), with molecular formula C24H32N2O2S and molecular weight 412.22 g/mol. IUPAC: [1-[4-(diethylamino)phenyl]-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-thiophen-2-ylmethanone.
Chemical Property Profile of [1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone
Property Insights of [1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone
The XLogP value of 5.1028 indicates that [1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.78 Ų, [1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone?
The CAS number of [1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone is 1005072-41-2.
What is the molecular formula of [1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone?
The molecular formula of [1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone is C24H32N2O2S.
What is the molecular weight of [1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone?
The molecular weight of [1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone is 412.22 g/mol.
Where can I buy [1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone?
You can request a quote for [1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone?
Yes, KEHONG BIO provides custom synthesis services for [1-(4-Diethylamino-phenyl)-4a-hydroxy-octahydro-isoquinolin-2-yl]-thiophen-2-yl-methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.