2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate
TL;DR: 2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate (CAS 301352-30-7) is a chemical compound with molecular formula C17H16Cl2N2O4S and molecular weight 414.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxyethyl N-[[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl]carbamate
Also Known As: BAS 00327485, 2-METHOXYETHYL N-{[3-CHLORO-4-(4-CHLOROPHENOXY)PHENYL]CARBAMOTHIOYL}CARBAMATE, 2-methoxyethyl N-[[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl]carbamate, F0266-0348, 2-methoxyethyl {[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate
| Molecular Formula | C17H16Cl2N2O4S |
|---|---|
| Molecular Weight | 414.02 g/mol |
| LogP | 4.8551 |
| Topological Polar Surface Area | 68.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 414.02078 |
| Heavy Atoms | 26 |
| Complexity | 771.8582 |
Chemical Identifiers
| CAS Number | 301352-30-7 |
|---|---|
| SMILES | COCCOC(=O)NC(=S)NC1=CC(=C(C=C1)OC2=CC=C(C=C2)Cl)Cl |
Product Overview
2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate (CAS 301352-30-7), with molecular formula C17H16Cl2N2O4S and molecular weight 414.02 g/mol. IUPAC: 2-methoxyethyl N-[[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl]carbamate.
Chemical Property Profile of 2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate
Property Insights of 2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate
The XLogP value of 4.8551 indicates that 2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate. Following Lipinski's Rule of Five, 2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate has 2 hydrogen bond donor(s) and 5 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 2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate?
The CAS number of 2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate is 301352-30-7.
What is the molecular formula of 2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate?
The molecular formula of 2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate is C17H16Cl2N2O4S.
What is the molecular weight of 2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate?
The molecular weight of 2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate is 414.02 g/mol.
Where can I buy 2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate?
You can request a quote for 2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxyethyl N-{[3-chloro-4-(4-chlorophenoxy)phenyl]carbamothioyl}carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.