环己基乙基硫代氨基甲酸
TL;DR: 环己基乙基硫代氨基甲酸 (CAS 71193-01-6) is a chemical compound with molecular formula CCN(C1CCCCC1)C(=O)S and molecular weight 187.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
环己基乙基硫代氨基甲酸
cyclohexyl(ethyl)carbamothioic S-acid
Also Known As: N-Et cyclohexylthiocarbamate, N-ethylcyclohexylthiocarbamate, Carbamothioic acid, cyclohexylethyl-, cyclohexyl(ethyl)carbamothioic S-acid, Carbamothioic acid,cyclohexylethyl- (9CI)
| Molecular Formula | CCN(C1CCCCC1)C(=O)S |
|---|---|
| Molecular Weight | 187.10 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.10309 |
| Heavy Atoms | 12 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 71193-01-6 |
|---|---|
| SMILES | CCN(C1CCCCC1)C(=O)S |
| InChIKey | OAVZKNPXSOCTMP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
环己基乙基硫代氨基甲酸 (CAS 71193-01-6), with molecular formula CCN(C1CCCCC1)C(=O)S and molecular weight 187.10 g/mol. IUPAC: cyclohexyl(ethyl)carbamothioic S-acid.
Chemical Property Profile of 环己基乙基硫代氨基甲酸
Property Insights of 环己基乙基硫代氨基甲酸
The XLogP value of 3.4 indicates that 环己基乙基硫代氨基甲酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.3 Ų, 环己基乙基硫代氨基甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 环己基乙基硫代氨基甲酸 has 1 hydrogen bond donor(s) and 2 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 环己基乙基硫代氨基甲酸?
The CAS number of 环己基乙基硫代氨基甲酸 is 71193-01-6.
What is the molecular formula of 环己基乙基硫代氨基甲酸?
The molecular formula of 环己基乙基硫代氨基甲酸 is CCN(C1CCCCC1)C(=O)S.
What is the molecular weight of 环己基乙基硫代氨基甲酸?
The molecular weight of 环己基乙基硫代氨基甲酸 is 187.10 g/mol.
Where can I buy 环己基乙基硫代氨基甲酸?
You can request a quote for 环己基乙基硫代氨基甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 环己基乙基硫代氨基甲酸?
Yes, KEHONG BIO provides custom synthesis services for 环己基乙基硫代氨基甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.