![N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide structure](/static/products/890/89069-95-4.png)
N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide
TL;DR: N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide (CAS 89069-95-4) 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-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]benzamide
Also Known As: N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide, N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]benzamide, N-({[2-chloro-5-(trifluoromethyl)phenyl]amino}carbonothioyl)benzamide, N-[[[2-Chloro-5-(trifluoromethyl)phenyl]amino]thioxomethyl]benzamide, Benzamide, N-[[[2-chloro-5-(trifluoromethyl)phenyl]amino]thioxomethyl]-
| 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 | 89069-95-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)Cl |
Product Overview
N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide (CAS 89069-95-4), with molecular formula C15H10ClF3N2OS and molecular weight 358.02 g/mol. IUPAC: N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]benzamide.
Chemical Property Profile of N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide
Property Insights of N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide
The XLogP value of 4.4856 indicates that N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide 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-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide 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-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide?
The CAS number of N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide is 89069-95-4.
What is the molecular formula of N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide?
The molecular formula of N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide is C15H10ClF3N2OS.
What is the molecular weight of N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide?
The molecular weight of N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide is 358.02 g/mol.
Where can I buy N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide?
You can request a quote for N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.