N-(2-chlorocyclohexyl)methylthiocarboxamide
TL;DR: N-(2-chlorocyclohexyl)methylthiocarboxamide (CAS 17643-62-8) is a chemical compound with molecular formula C8H14ClNOS and molecular weight 207.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-methyl N-(2-chlorocyclohexyl)carbamothioate
Also Known As: N-(2-chlorocyclohexyl)methylthiocarboxamide, S-Methyl (2-chlorocyclohexyl)carbamothioate, S-methyl N-(2-chlorocyclohexyl)carbamothioate, N-(2-chlorocyclohexyl)(methylsulfanyl)formamide, S-METHYL 2-CHLOROCYCLOHEXYLTHIOCARBAMATE
| Molecular Formula | C8H14ClNOS |
|---|---|
| Molecular Weight | 207.05 g/mol |
| LogP | 2.609 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 207.04846 |
| Heavy Atoms | 12 |
| Complexity | 165.13686 |
Chemical Identifiers
| CAS Number | 17643-62-8 |
|---|---|
| SMILES | CSC(=O)NC1CCCCC1Cl |
Product Overview
N-(2-chlorocyclohexyl)methylthiocarboxamide (CAS 17643-62-8), with molecular formula C8H14ClNOS and molecular weight 207.05 g/mol. IUPAC: S-methyl N-(2-chlorocyclohexyl)carbamothioate.
Chemical Property Profile of N-(2-chlorocyclohexyl)methylthiocarboxamide
Property Insights of N-(2-chlorocyclohexyl)methylthiocarboxamide
The XLogP value of 2.609 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-chlorocyclohexyl)methylthiocarboxamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-(2-chlorocyclohexyl)methylthiocarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-chlorocyclohexyl)methylthiocarboxamide 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)methylthiocarboxamide?
The CAS number of N-(2-chlorocyclohexyl)methylthiocarboxamide is 17643-62-8.
What is the molecular formula of N-(2-chlorocyclohexyl)methylthiocarboxamide?
The molecular formula of N-(2-chlorocyclohexyl)methylthiocarboxamide is C8H14ClNOS.
What is the molecular weight of N-(2-chlorocyclohexyl)methylthiocarboxamide?
The molecular weight of N-(2-chlorocyclohexyl)methylthiocarboxamide is 207.05 g/mol.
Where can I buy N-(2-chlorocyclohexyl)methylthiocarboxamide?
You can request a quote for N-(2-chlorocyclohexyl)methylthiocarboxamide 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)methylthiocarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-chlorocyclohexyl)methylthiocarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.