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N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide
TL;DR: N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide (CAS 429642-54-6) is a chemical compound with molecular formula C11H11F3N2OS and molecular weight 276.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide
Also Known As: N-propionyl-N'-[2-(trifluoromethyl)phenyl]thiourea, N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide, AB00111194-01, N-Propionyl-N/'-[2-(trifluoromethyl)phenyl]thiourea, N-{[2-(trifluoromethyl)phenyl]carbamothioyl}propanamide
| Molecular Formula | C11H11F3N2OS |
|---|---|
| Molecular Weight | 276.05 g/mol |
| LogP | 2.9284 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 276.0544 |
| Heavy Atoms | 18 |
| Complexity | 459.8467 |
Chemical Identifiers
| CAS Number | 429642-54-6 |
|---|---|
| SMILES | CCC(=O)NC(=S)NC1=CC=CC=C1C(F)(F)F |
Product Overview
N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide (CAS 429642-54-6), with molecular formula C11H11F3N2OS and molecular weight 276.05 g/mol. IUPAC: N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide.
Chemical Property Profile of N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide
Property Insights of N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide
The XLogP value of 2.9284 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide. With a topological polar surface area (TPSA) of 41.13 Ų, N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide 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-(trifluoromethyl)phenyl]carbamothioyl]propanamide?
The CAS number of N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide is 429642-54-6.
What is the molecular formula of N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide?
The molecular formula of N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide is C11H11F3N2OS.
What is the molecular weight of N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide?
The molecular weight of N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide is 276.05 g/mol.
Where can I buy N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide?
You can request a quote for N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[2-(trifluoromethyl)phenyl]carbamothioyl]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.