1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea
TL;DR: 1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea (CAS 206559-47-9) is a chemical compound with molecular formula C8H6BrF3N2S and molecular weight 297.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-bromo-5-(trifluoromethyl)phenyl]thiourea
Also Known As: 1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea, [2-bromo-5-(trifluoromethyl)phenyl]thiourea, 1-(2-Bromo-5-(trifluoromethyl)phenyl)thiourea, 1-[2-bromo-5-(trifluoromethyl)phenyl]-2-thiourea, (2-Bromo-5-trifluoromethyl)phenylthiourea
| Molecular Formula | C8H6BrF3N2S |
|---|---|
| Molecular Weight | 297.94 g/mol |
| LogP | 3.1234 |
| Topological Polar Surface Area | 38.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 297.93872 |
| Heavy Atoms | 15 |
| Complexity | 391.96344 |
Chemical Identifiers
| CAS Number | 206559-47-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(F)(F)F)NC(=S)N)Br |
Product Overview
1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea (CAS 206559-47-9), with molecular formula C8H6BrF3N2S and molecular weight 297.94 g/mol. IUPAC: [2-bromo-5-(trifluoromethyl)phenyl]thiourea.
Chemical Property Profile of 1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea
Property Insights of 1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea
The XLogP value of 3.1234 indicates that 1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.05 Ų, 1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea has 2 hydrogen bond donor(s) and 1 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 1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea?
The CAS number of 1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea is 206559-47-9.
What is the molecular formula of 1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea?
The molecular formula of 1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea is C8H6BrF3N2S.
What is the molecular weight of 1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea?
The molecular weight of 1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea is 297.94 g/mol.
Where can I buy 1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea?
You can request a quote for 1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Bromo-5-trifluoromethylphenyl)-2-thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.