![N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide structure](/static/products/4284/428468-29-5.webp)
N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide
TL;DR: N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide (CAS 428468-29-5) is a chemical compound with molecular formula C17H14ClF3N2O2S and molecular weight 402.04 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]-3-ethoxybenzamide
Also Known As: N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide, N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}-3-ethoxybenzamide
| Molecular Formula | C17H14ClF3N2O2S |
|---|---|
| Molecular Weight | 402.04 g/mol |
| LogP | 4.8843 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.04166 |
| Heavy Atoms | 26 |
| Complexity | 827.89557 |
Chemical Identifiers
| CAS Number | 428468-29-5 |
|---|---|
| SMILES | CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)Cl |
Product Overview
N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide (CAS 428468-29-5), with molecular formula C17H14ClF3N2O2S and molecular weight 402.04 g/mol. IUPAC: N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide.
Chemical Property Profile of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide
Property Insights of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide
The XLogP value of 4.8843 indicates that N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide has 2 hydrogen bond donor(s) and 3 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]-3-ethoxybenzamide?
The CAS number of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide is 428468-29-5.
What is the molecular formula of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide?
The molecular formula of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide is C17H14ClF3N2O2S.
What is the molecular weight of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide?
The molecular weight of N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide is 402.04 g/mol.
Where can I buy N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide?
You can request a quote for N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide 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]-3-ethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-3-ethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.