![N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide structure](/static/products/4284/428450-47-9.webp)
N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide
TL;DR: N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide (CAS 428450-47-9) is a chemical compound with molecular formula C16H12ClF3N2OS and molecular weight 372.03 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]-2-methylbenzamide
Also Known As: AB00106942-01, N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide, N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}-2-methylbenzamide, 1-[2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL]-3-(2-METHYLBENZOYL)THIOUREA
| Molecular Formula | C16H12ClF3N2OS |
|---|---|
| Molecular Weight | 372.03 g/mol |
| LogP | 4.79402 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 372.0311 |
| Heavy Atoms | 24 |
| Complexity | 793.13226 |
Chemical Identifiers
| CAS Number | 428450-47-9 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)Cl |
Product Overview
N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide (CAS 428450-47-9), with molecular formula C16H12ClF3N2OS and molecular weight 372.03 g/mol. IUPAC: N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide.
Chemical Property Profile of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide
Property Insights of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide
The XLogP value of 4.79402 indicates that N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide 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]-2-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide 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]-2-methylbenzamide?
The CAS number of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide is 428450-47-9.
What is the molecular formula of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide?
The molecular formula of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide is C16H12ClF3N2OS.
What is the molecular weight of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide?
The molecular weight of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide is 372.03 g/mol.
Where can I buy N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide?
You can request a quote for N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide 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]-2-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.