2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate
TL;DR: 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate (CAS 331272-91-4) is a chemical compound with molecular formula C21H22Cl2N2O3S and molecular weight 452.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[2-(2,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-2-methylpropyl] N-(4-methylphenyl)carbamate
Also Known As: 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate, [2-[2-(2,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-2-methylpropyl] N-(4-methylphenyl)carbamate, 2-[2-(2,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-2-methylpropyl (4-methylphenyl)carbamate
| Molecular Formula | C21H22Cl2N2O3S |
|---|---|
| Molecular Weight | 452.07 g/mol |
| LogP | 5.90312 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 452.0728 |
| Heavy Atoms | 29 |
| Complexity | 918.6423 |
Chemical Identifiers
| CAS Number | 331272-91-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)OCC(C)(C)N2C(SCC2=O)C3=C(C=C(C=C3)Cl)Cl |
Product Overview
2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate (CAS 331272-91-4), with molecular formula C21H22Cl2N2O3S and molecular weight 452.07 g/mol. IUPAC: [2-[2-(2,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-2-methylpropyl] N-(4-methylphenyl)carbamate.
Chemical Property Profile of 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate
Property Insights of 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate
The XLogP value of 5.90312 indicates that 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate?
The CAS number of 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate is 331272-91-4.
What is the molecular formula of 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate?
The molecular formula of 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate is C21H22Cl2N2O3S.
What is the molecular weight of 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate?
The molecular weight of 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate is 452.07 g/mol.
Where can I buy 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate?
You can request a quote for 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-(2,4-dichlorophenyl)-4-oxothiazolidin-3-yl)-2-methylpropyl p-tolylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.