![N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide structure](/static/products/7012/701238-71-3.webp)
N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide
TL;DR: N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide (CAS 701238-71-3) is a chemical compound with molecular formula C17H14ClF3N2O3S and molecular weight 418.04 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]-2,6-dimethoxybenzamide
Also Known As: N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide, N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}-2,6-dimethoxybenzamide
| Molecular Formula | C17H14ClF3N2O3S |
|---|---|
| Molecular Weight | 418.04 g/mol |
| LogP | 4.5028 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 418.0366 |
| Heavy Atoms | 27 |
| Complexity | 852.7375 |
Chemical Identifiers
| CAS Number | 701238-71-3 |
|---|---|
| SMILES | COC1=C(C(=CC=C1)OC)C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)Cl |
Product Overview
N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide (CAS 701238-71-3), with molecular formula C17H14ClF3N2O3S and molecular weight 418.04 g/mol. IUPAC: N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide.
Chemical Property Profile of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide
Property Insights of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide
The XLogP value of 4.5028 indicates that N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.59 Ų, N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide has 2 hydrogen bond donor(s) and 4 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]-2,6-dimethoxybenzamide?
The CAS number of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide is 701238-71-3.
What is the molecular formula of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide?
The molecular formula of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide is C17H14ClF3N2O3S.
What is the molecular weight of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide?
The molecular weight of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide is 418.04 g/mol.
Where can I buy N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide?
You can request a quote for N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide 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]-2,6-dimethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.