(5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine
TL;DR: (5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine (CAS 81004-88-8) is a chemical compound with molecular formula C12H17NOS2 and molecular weight 255.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(cyclohexyliminomethyl)-5-methoxythiophene-2-thiol
Also Known As: (5-methoxy-2-mercapto-3-thenylidene)cyclohexylamine, 3-[(cyclohexylamino)methylidene]-5-methoxythiophene-2-thione, (3E)-3-[(cyclohexylamino)methylidene]-5-methoxythiophene-2-thione, (3Z)-3-[(cyclohexylamino)methylidene]-5-methoxythiophene-2-thione
| Molecular Formula | C12H17NOS2 |
|---|---|
| Molecular Weight | 255.08 g/mol |
| LogP | 3.797 |
| Topological Polar Surface Area | 21.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 255.07515 |
| Heavy Atoms | 16 |
| Complexity | 367.0957 |
Chemical Identifiers
| CAS Number | 81004-88-8 |
|---|---|
| SMILES | COC1=CC(=C(S1)S)C=NC2CCCCC2 |
Product Overview
(5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine (CAS 81004-88-8), with molecular formula C12H17NOS2 and molecular weight 255.08 g/mol. IUPAC: 3-(cyclohexyliminomethyl)-5-methoxythiophene-2-thiol.
Chemical Property Profile of (5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine
Property Insights of (5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine
The XLogP value of 3.797 indicates that (5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.59 Ų, (5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine has 1 hydrogen bond donor(s) and 4 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 (5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine?
The CAS number of (5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine is 81004-88-8.
What is the molecular formula of (5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine?
The molecular formula of (5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine is C12H17NOS2.
What is the molecular weight of (5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine?
The molecular weight of (5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine is 255.08 g/mol.
Where can I buy (5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine?
You can request a quote for (5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine?
Yes, KEHONG BIO provides custom synthesis services for (5-Methoxy-2-mercapto-3-thenylidene)cyclohexylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.