N-benzoyl-N'-(4-ethoxyphenyl)thiourea
TL;DR: N-benzoyl-N'-(4-ethoxyphenyl)thiourea (CAS 83697-75-0) is a chemical compound with molecular formula C16H16N2O2S and molecular weight 300.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-ethoxyphenyl)carbamothioyl]benzamide
Also Known As: N-benzoyl-N'-(4-ethoxyphenyl)thiourea, N-((4-Ethoxyphenyl)carbamothioyl)benzamide, N-[(4-ethoxyphenyl)carbamothioyl]benzamide, 3-benzoyl-1-(4-ethoxyphenyl)thiourea, Benzamide, N-[[(4-ethoxyphenyl)amino]thioxomethyl]-
| Molecular Formula | C16H16N2O2S |
|---|---|
| Molecular Weight | 300.09 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 82.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.09326 |
| Heavy Atoms | 21 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 83697-75-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2 |
| InChIKey | SZRSPFVIUYFBER-UHFFFAOYSA-N |
Product Overview
N-benzoyl-N'-(4-ethoxyphenyl)thiourea (CAS 83697-75-0), with molecular formula C16H16N2O2S and molecular weight 300.09 g/mol. IUPAC: N-[(4-ethoxyphenyl)carbamothioyl]benzamide.
Chemical Property Profile of N-benzoyl-N'-(4-ethoxyphenyl)thiourea
Property Insights of N-benzoyl-N'-(4-ethoxyphenyl)thiourea
The XLogP value of 4.3 indicates that N-benzoyl-N'-(4-ethoxyphenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-benzoyl-N'-(4-ethoxyphenyl)thiourea. Following Lipinski's Rule of Five, N-benzoyl-N'-(4-ethoxyphenyl)thiourea 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 N-benzoyl-N'-(4-ethoxyphenyl)thiourea?
The CAS number of N-benzoyl-N'-(4-ethoxyphenyl)thiourea is 83697-75-0.
What is the molecular formula of N-benzoyl-N'-(4-ethoxyphenyl)thiourea?
The molecular formula of N-benzoyl-N'-(4-ethoxyphenyl)thiourea is C16H16N2O2S.
What is the molecular weight of N-benzoyl-N'-(4-ethoxyphenyl)thiourea?
The molecular weight of N-benzoyl-N'-(4-ethoxyphenyl)thiourea is 300.09 g/mol.
Where can I buy N-benzoyl-N'-(4-ethoxyphenyl)thiourea?
You can request a quote for N-benzoyl-N'-(4-ethoxyphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzoyl-N'-(4-ethoxyphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-benzoyl-N'-(4-ethoxyphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.