2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide
TL;DR: 2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide (CAS 1024346-57-3) is a chemical compound with molecular formula C17H18BrN3O2S and molecular weight 407.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-(4-bromo-3,5-dimethylphenoxy)acetyl]amino]-3-phenylthiourea
Also Known As: 2-(4-BROMO-3,5-DIMETHYLPHENOXY)-N-(((PHENYLAMINO)THIOXOMETHYL)AMINO)ETHANAMIDE, 1-[[2-(4-bromo-3,5-dimethylphenoxy)acetyl]amino]-3-phenylthiourea, 1-[[2-(4-bromo-3,5-dimethyl-phenoxy)acetyl]amino]-3-phenyl-thiourea, 2-(4-bromo-3,5-dimethylphenoxy)-N-[(phenylcarbamothioyl)amino]acetamide, 3-[[2-(4-bromo-3,5-dimethyl-phenoxy)acetyl]amino]-1-phenyl-thiourea
| Molecular Formula | C17H18BrN3O2S |
|---|---|
| Molecular Weight | 407.03 g/mol |
| LogP | 3.46254 |
| Topological Polar Surface Area | 62.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.0303 |
| Heavy Atoms | 24 |
| Complexity | 714.86554 |
Chemical Identifiers
| CAS Number | 1024346-57-3 |
|---|---|
| SMILES | CC1=CC(=CC(=C1Br)C)OCC(=O)NNC(=S)NC2=CC=CC=C2 |
Product Overview
2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide (CAS 1024346-57-3), with molecular formula C17H18BrN3O2S and molecular weight 407.03 g/mol. IUPAC: 1-[[2-(4-bromo-3,5-dimethylphenoxy)acetyl]amino]-3-phenylthiourea.
Chemical Property Profile of 2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide
Property Insights of 2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide
The XLogP value of 3.46254 indicates that 2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide. Following Lipinski's Rule of Five, 2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide has 3 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 2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide?
The CAS number of 2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide is 1024346-57-3.
What is the molecular formula of 2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide?
The molecular formula of 2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide is C17H18BrN3O2S.
What is the molecular weight of 2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide?
The molecular weight of 2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide is 407.03 g/mol.
Where can I buy 2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide?
You can request a quote for 2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Bromo-3,5-dimethylphenoxy)-N-(((phenylamino)thioxomethyl)amino)ethanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.