![(2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide structure](/static/products/881/881450-98-2.png)
(2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide
TL;DR: (2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide (CAS 881450-98-2) is a chemical compound with molecular formula C16H18N4S and molecular weight 298.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-(2-isoquinolin-1-ylcyclohexylidene)amino]thiourea
Also Known As: AB01334502-02, (2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide, (E)-2-(2-(isoquinolin-1-yl)cyclohexylidene)hydrazinecarbothioamide
| Molecular Formula | C16H18N4S |
|---|---|
| Molecular Weight | 298.13 g/mol |
| LogP | 3.0816 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 298.1252 |
| Heavy Atoms | 21 |
| Complexity | 690.2414 |
Chemical Identifiers
| CAS Number | 881450-98-2 |
|---|---|
| SMILES | C1CC/C(=N\NC(=S)N)/C(C1)C2=NC=CC3=CC=CC=C32 |
Product Overview
(2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide (CAS 881450-98-2), with molecular formula C16H18N4S and molecular weight 298.13 g/mol. IUPAC: [(E)-(2-isoquinolin-1-ylcyclohexylidene)amino]thiourea.
Chemical Property Profile of (2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide
Property Insights of (2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide
The XLogP value of 3.0816 indicates that (2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide. Following Lipinski's Rule of Five, (2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide 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 (2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide?
The CAS number of (2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide is 881450-98-2.
What is the molecular formula of (2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide?
The molecular formula of (2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide is C16H18N4S.
What is the molecular weight of (2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide?
The molecular weight of (2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide is 298.13 g/mol.
Where can I buy (2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide?
You can request a quote for (2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-[2-(isoquinolin-1-yl)cyclohexylidene]hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.