Ethyl 4-(3-(2,4-dichlorophenyl)ureido)benzoate
TL;DR: Ethyl 4-(3-(2,4-dichlorophenyl)ureido)benzoate (CAS 36034-82-9) is a chemical compound with molecular formula C16H14Cl2N2O3 and molecular weight 352.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(2,4-dichlorophenyl)carbamoylamino]benzoate
Also Known As: ethyl 4-[(2,4-dichlorophenyl)carbamoylamino]benzoate, Ethyl 4-(3-(2,4-dichlorophenyl)ureido)benzoate, ethyl 4-{[(2,4-dichlorophenyl)carbamoyl]amino}benzoate, 667-803-1, RefChem:595203
| Molecular Formula | C16H14Cl2N2O3 |
|---|---|
| Molecular Weight | 352.04 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 352.03815 |
| Heavy Atoms | 23 |
| Complexity | 414.0 |
Chemical Identifiers
| CAS Number | 36034-82-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=C(C=C(C=C2)Cl)Cl |
| InChIKey | FILWLKBAVJRJLG-UHFFFAOYSA-N |
Product Overview
Ethyl 4-(3-(2,4-dichlorophenyl)ureido)benzoate (CAS 36034-82-9), with molecular formula C16H14Cl2N2O3 and molecular weight 352.04 g/mol. IUPAC: ethyl 4-[(2,4-dichlorophenyl)carbamoylamino]benzoate.
Chemical Property Profile of Ethyl 4-(3-(2,4-dichlorophenyl)ureido)benzoate
Property Insights of Ethyl 4-(3-(2,4-dichlorophenyl)ureido)benzoate
The XLogP value of 3.8 indicates that Ethyl 4-(3-(2,4-dichlorophenyl)ureido)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-(3-(2,4-dichlorophenyl)ureido)benzoate. Following Lipinski's Rule of Five, Ethyl 4-(3-(2,4-dichlorophenyl)ureido)benzoate has 2 hydrogen bond donor(s) and 3 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-(3-(2,4-dichlorophenyl)ureido)benzoate?
The CAS number of Ethyl 4-(3-(2,4-dichlorophenyl)ureido)benzoate is 36034-82-9.
What is the molecular formula of Ethyl 4-(3-(2,4-dichlorophenyl)ureido)benzoate?
The molecular formula of Ethyl 4-(3-(2,4-dichlorophenyl)ureido)benzoate is C16H14Cl2N2O3.
What is the molecular weight of Ethyl 4-(3-(2,4-dichlorophenyl)ureido)benzoate?
The molecular weight of Ethyl 4-(3-(2,4-dichlorophenyl)ureido)benzoate is 352.04 g/mol.
Where can I buy Ethyl 4-(3-(2,4-dichlorophenyl)ureido)benzoate?
You can request a quote for Ethyl 4-(3-(2,4-dichlorophenyl)ureido)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-(3-(2,4-dichlorophenyl)ureido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(3-(2,4-dichlorophenyl)ureido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.