1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea
TL;DR: 1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea (CAS 87555-55-3) is a chemical compound with molecular formula C19H26N4S and molecular weight 342.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea
Also Known As: J1.592.809C, 1-cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea, 1-cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiour, 3-cyclohexyl-1-{[1-(isoquinolin-1-yl)ethyl]amino}-3-methylthiourea, N-Cyclohexyl-2-[1-(1-isoquinolinyl)ethyl]-N-methylhydrazinecarbothioamide #
| Molecular Formula | C19H26N4S |
|---|---|
| Molecular Weight | 342.19 g/mol |
| LogP | 3.9394 |
| Topological Polar Surface Area | 40.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.1878 |
| Heavy Atoms | 24 |
| Complexity | 691.3312 |
Chemical Identifiers
| CAS Number | 87555-55-3 |
|---|---|
| SMILES | CC(C1=NC=CC2=CC=CC=C21)NNC(=S)N(C)C3CCCCC3 |
Product Overview
1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea (CAS 87555-55-3), with molecular formula C19H26N4S and molecular weight 342.19 g/mol. IUPAC: 1-cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea.
Chemical Property Profile of 1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea
Property Insights of 1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea
The XLogP value of 3.9394 indicates that 1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.19 Ų, 1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea 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 1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea?
The CAS number of 1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea is 87555-55-3.
What is the molecular formula of 1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea?
The molecular formula of 1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea is C19H26N4S.
What is the molecular weight of 1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea?
The molecular weight of 1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea is 342.19 g/mol.
Where can I buy 1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea?
You can request a quote for 1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Cyclohexyl-3-(1-isoquinolin-1-ylethylamino)-1-methylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.