![N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]thiourea structure](/static/products/4778/477868-76-1.webp)
N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]thiourea
TL;DR: N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]thiourea (CAS 477868-76-1) is a chemical compound with molecular formula C15H10ClF3N2OS and molecular weight 358.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-chloro-3-(trifluoromethyl)phenyl]carbamothioyl]benzamide
Also Known As: Bionet1_003353, N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]thiourea, 1-benzoyl-3-[4-chloro-3-(trifluoromethyl)phenyl]thiourea, 1P-102, N-[[4-chloro-3-(trifluoromethyl)phenyl]carbamothioyl]benzamide
| Molecular Formula | C15H10ClF3N2OS |
|---|---|
| Molecular Weight | 358.02 g/mol |
| LogP | 4.4856 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 358.01544 |
| Heavy Atoms | 23 |
| Complexity | 735.247 |
Chemical Identifiers
| CAS Number | 477868-76-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)C(F)(F)F |
Product Overview
N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]thiourea (CAS 477868-76-1), with molecular formula C15H10ClF3N2OS and molecular weight 358.02 g/mol. IUPAC: N-[[4-chloro-3-(trifluoromethyl)phenyl]carbamothioyl]benzamide.
Chemical Property Profile of N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]thiourea
Property Insights of N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]thiourea
The XLogP value of 4.4856 indicates that N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]thiourea has 2 hydrogen bond donor(s) and 2 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-chloro-3-(trifluoromethyl)phenyl]thiourea?
The CAS number of N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]thiourea is 477868-76-1.
What is the molecular formula of N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]thiourea?
The molecular formula of N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]thiourea is C15H10ClF3N2OS.
What is the molecular weight of N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]thiourea?
The molecular weight of N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]thiourea is 358.02 g/mol.
Where can I buy N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]thiourea?
You can request a quote for N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]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-chloro-3-(trifluoromethyl)phenyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-benzoyl-N'-[4-chloro-3-(trifluoromethyl)phenyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.