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N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide
TL;DR: N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide (CAS 425666-87-1) is a chemical compound with molecular formula C16H14FN3O2S and molecular weight 331.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide
Also Known As: N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide, N-{[4-(acetylamino)phenyl]carbamothioyl}-2-fluorobenzamide, N-[4-({[(2-fluorobenzoyl)amino]carbothioyl}amino)phenyl]acetamide
| Molecular Formula | C16H14FN3O2S |
|---|---|
| Molecular Weight | 331.08 g/mol |
| LogP | 2.9109 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.07907 |
| Heavy Atoms | 23 |
| Complexity | 747.2455 |
Chemical Identifiers
| CAS Number | 425666-87-1 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2F |
Product Overview
N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide (CAS 425666-87-1), with molecular formula C16H14FN3O2S and molecular weight 331.08 g/mol. IUPAC: N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide.
Chemical Property Profile of N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide
Property Insights of N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide
The XLogP value of 2.9109 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide. Following Lipinski's Rule of Five, N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide has 3 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-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide?
The CAS number of N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide is 425666-87-1.
What is the molecular formula of N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide?
The molecular formula of N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide is C16H14FN3O2S.
What is the molecular weight of N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide?
The molecular weight of N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide is 331.08 g/mol.
Where can I buy N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide?
You can request a quote for N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-acetamidophenyl)carbamothioyl]-2-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.