![3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide structure](/static/products/4454/445420-08-6.webp)
3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide
TL;DR: 3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide (CAS 445420-08-6) 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.
3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide
Also Known As: AN-465/41168670, 3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide, 3-chloro-4-methyl-N-{[3-(trifluoromethyl)phenyl]carbamothioyl}benzamide, N-(3-chloro-4-methylbenzoyl)-N'-[3-(trifluoromethyl)phenyl]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 | 445420-08-6 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(F)(F)F)Cl |
Product Overview
3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide (CAS 445420-08-6), with molecular formula C16H12ClF3N2OS and molecular weight 372.03 g/mol. IUPAC: 3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide.
Chemical Property Profile of 3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide
Property Insights of 3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide
The XLogP value of 4.79402 indicates that 3-chloro-4-methyl-N-[[3-(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, 3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-4-methyl-N-[[3-(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 3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide?
The CAS number of 3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide is 445420-08-6.
What is the molecular formula of 3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide?
The molecular formula of 3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide is C16H12ClF3N2OS.
What is the molecular weight of 3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide?
The molecular weight of 3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide is 372.03 g/mol.
Where can I buy 3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide?
You can request a quote for 3-chloro-4-methyl-N-[[3-(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 3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.