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Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate
TL;DR: Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate (CAS 433262-19-2) is a chemical compound with molecular formula C18H20N2O4S and molecular weight 360.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(2,4-dimethoxyphenyl)carbamothioylamino]benzoate
Also Known As: ethyl 4-(3-(2,4-dimethoxyphenyl)thioureido)benzoate, ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate, ethyl 4-[(2,4-dimethoxyphenyl)carbamothioylamino]benzoate, ethyl 4-({[(2,4-dimethoxyphenyl)amino]thioxomethyl}amino)benzoate, ETHYL 4-{[(2,4-DIMETHOXYANILINO)CARBOTHIOYL]AMINO}BENZOATE
| Molecular Formula | C18H20N2O4S |
|---|---|
| Molecular Weight | 360.11 g/mol |
| LogP | 3.6894 |
| Topological Polar Surface Area | 68.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 360.11438 |
| Heavy Atoms | 25 |
| Complexity | 747.24133 |
Chemical Identifiers
| CAS Number | 433262-19-2 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=C(C=C(C=C2)OC)OC |
Product Overview
Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate (CAS 433262-19-2), with molecular formula C18H20N2O4S and molecular weight 360.11 g/mol. IUPAC: ethyl 4-[(2,4-dimethoxyphenyl)carbamothioylamino]benzoate.
Chemical Property Profile of Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate
Property Insights of Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate
The XLogP value of 3.6894 indicates that Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate 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 Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate. Following Lipinski's Rule of Five, Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate 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 Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate?
The CAS number of Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate is 433262-19-2.
What is the molecular formula of Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate?
The molecular formula of Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate is C18H20N2O4S.
What is the molecular weight of Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate?
The molecular weight of Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate is 360.11 g/mol.
Where can I buy Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate?
You can request a quote for Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.