S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate
TL;DR: S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate (CAS 197170-51-7) is a chemical compound with molecular formula C14H11Cl2NOS and molecular weight 310.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(4-chlorophenyl) N-(4-chloro-2-methylphenyl)carbamothioate
Also Known As: S-(4-CHLOROPHENYL) N-(4-CHLORO-2-METHYLPHENYL)THIOCARBAMATE, S-(4-chlorophenyl) N-(4-chloro-2-methylphenyl)carbamothioate, N-(4-chloro-2-methyl-phenyl)-1-(4-chlorophenyl)sulfanyl-formamide
| Molecular Formula | C14H11Cl2NOS |
|---|---|
| Molecular Weight | 310.99 g/mol |
| LogP | 5.62602 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 310.99384 |
| Heavy Atoms | 19 |
| Complexity | 598.895 |
Chemical Identifiers
| CAS Number | 197170-51-7 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)NC(=O)SC2=CC=C(C=C2)Cl |
Product Overview
S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate (CAS 197170-51-7), with molecular formula C14H11Cl2NOS and molecular weight 310.99 g/mol. IUPAC: S-(4-chlorophenyl) N-(4-chloro-2-methylphenyl)carbamothioate.
Chemical Property Profile of S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate
Property Insights of S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate
The XLogP value of 5.62602 indicates that S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate?
The CAS number of S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate is 197170-51-7.
What is the molecular formula of S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate?
The molecular formula of S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate is C14H11Cl2NOS.
What is the molecular weight of S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate?
The molecular weight of S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate is 310.99 g/mol.
Where can I buy S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate?
You can request a quote for S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate?
Yes, KEHONG BIO provides custom synthesis services for S-(4-Chlorophenyl) N-(4-chloro-2-methylphenyl)thiocarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.