1-(2-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)thiourea
TL;DR: 1-(2-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)thiourea (CAS 1022045-41-5) is a chemical compound with molecular formula C16H15F3N2S and molecular weight 324.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methylphenyl)-3-[[3-(trifluoromethyl)phenyl]methyl]thiourea
Also Known As: 1-(2-METHYLPHENYL)-3-((3-(TRIFLUOROMETHYL)PHENYL)METHYL)THIOUREA, 1-(2-methylphenyl)-3-[[3-(trifluoromethyl)phenyl]methyl]thiourea, 1-(o-tolyl)-3-[[3-(trifluoromethyl)phenyl]methyl]thiourea, 1-(2-methylphenyl)-3-{[3-(trifluoromethyl)phenyl]methyl}thiourea, 3-(2-methylphenyl)-1-[[3-(trifluoromethyl)phenyl]methyl]thiourea
| Molecular Formula | C16H15F3N2S |
|---|---|
| Molecular Weight | 324.09 g/mol |
| LogP | 4.50042 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.0908 |
| Heavy Atoms | 22 |
| Complexity | 668.43567 |
Chemical Identifiers
| CAS Number | 1022045-41-5 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=S)NCC2=CC(=CC=C2)C(F)(F)F |
Product Overview
1-(2-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)thiourea (CAS 1022045-41-5), with molecular formula C16H15F3N2S and molecular weight 324.09 g/mol. IUPAC: 1-(2-methylphenyl)-3-[[3-(trifluoromethyl)phenyl]methyl]thiourea.
Chemical Property Profile of 1-(2-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)thiourea
Property Insights of 1-(2-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)thiourea
The XLogP value of 4.50042 indicates that 1-(2-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.06 Ų, 1-(2-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)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-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)thiourea?
The CAS number of 1-(2-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)thiourea is 1022045-41-5.
What is the molecular formula of 1-(2-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)thiourea?
The molecular formula of 1-(2-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)thiourea is C16H15F3N2S.
What is the molecular weight of 1-(2-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)thiourea?
The molecular weight of 1-(2-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)thiourea is 324.09 g/mol.
Where can I buy 1-(2-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)thiourea?
You can request a quote for 1-(2-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)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-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Methylphenyl)-3-((3-(trifluoromethyl)phenyl)methyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.