N-(2-chlorocyclohexyl)ethylthiocarboxamide
TL;DR: N-(2-chlorocyclohexyl)ethylthiocarboxamide (CAS 17643-64-0) is a chemical compound with molecular formula C9H16ClNOS and molecular weight 221.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-ethyl N-(2-chlorocyclohexyl)carbamothioate
Also Known As: N-(2-chlorocyclohexyl)ethylthiocarboxamide, S-Ethyl (2-chlorocyclohexyl)carbamothioate, S-ethyl N-(2-chlorocyclohexyl)carbamothioate, S-ETHYL 2-CHLOROCYCLOHEXYLTHIOCARBAMATE, N-(2-chlorocyclohexyl)(ethylsulfanyl)formamide
| Molecular Formula | C9H16ClNOS |
|---|---|
| Molecular Weight | 221.06 g/mol |
| LogP | 2.9991 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.06412 |
| Heavy Atoms | 13 |
| Complexity | 176.99763 |
Chemical Identifiers
| CAS Number | 17643-64-0 |
|---|---|
| SMILES | CCSC(=O)NC1CCCCC1Cl |
Product Overview
N-(2-chlorocyclohexyl)ethylthiocarboxamide (CAS 17643-64-0), with molecular formula C9H16ClNOS and molecular weight 221.06 g/mol. IUPAC: S-ethyl N-(2-chlorocyclohexyl)carbamothioate.
Chemical Property Profile of N-(2-chlorocyclohexyl)ethylthiocarboxamide
Property Insights of N-(2-chlorocyclohexyl)ethylthiocarboxamide
The XLogP value of 2.9991 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-chlorocyclohexyl)ethylthiocarboxamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-(2-chlorocyclohexyl)ethylthiocarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-chlorocyclohexyl)ethylthiocarboxamide 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 N-(2-chlorocyclohexyl)ethylthiocarboxamide?
The CAS number of N-(2-chlorocyclohexyl)ethylthiocarboxamide is 17643-64-0.
What is the molecular formula of N-(2-chlorocyclohexyl)ethylthiocarboxamide?
The molecular formula of N-(2-chlorocyclohexyl)ethylthiocarboxamide is C9H16ClNOS.
What is the molecular weight of N-(2-chlorocyclohexyl)ethylthiocarboxamide?
The molecular weight of N-(2-chlorocyclohexyl)ethylthiocarboxamide is 221.06 g/mol.
Where can I buy N-(2-chlorocyclohexyl)ethylthiocarboxamide?
You can request a quote for N-(2-chlorocyclohexyl)ethylthiocarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-chlorocyclohexyl)ethylthiocarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-chlorocyclohexyl)ethylthiocarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.