![2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide structure](/static/products/381/381697-62-7.png)
2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide
TL;DR: 2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide (CAS 381697-62-7) is a chemical compound with molecular formula C17H16FN3O2S and molecular weight 345.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide
Also Known As: 2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide, 2-fluoro-N-{[4-(propanoylamino)phenyl]carbamothioyl}benzamide, AN-648/40682793, 2-fluoro-N-((4-propionamidophenyl)carbamothioyl)benzamide, N-[4-({[(2-fluorobenzoyl)amino]carbothioyl}amino)phenyl]propanamide
| Molecular Formula | C17H16FN3O2S |
|---|---|
| Molecular Weight | 345.09 g/mol |
| LogP | 3.301 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.09473 |
| Heavy Atoms | 24 |
| Complexity | 762.6859 |
Chemical Identifiers
| CAS Number | 381697-62-7 |
|---|---|
| SMILES | CCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2F |
Product Overview
2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide (CAS 381697-62-7), with molecular formula C17H16FN3O2S and molecular weight 345.09 g/mol. IUPAC: 2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide.
Chemical Property Profile of 2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide
Property Insights of 2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide
The XLogP value of 3.301 indicates that 2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide. Following Lipinski's Rule of Five, 2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide 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 2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide?
The CAS number of 2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide is 381697-62-7.
What is the molecular formula of 2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide?
The molecular formula of 2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide is C17H16FN3O2S.
What is the molecular weight of 2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide?
The molecular weight of 2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide is 345.09 g/mol.
Where can I buy 2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide?
You can request a quote for 2-fluoro-N-[[4-(propanoylamino)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 2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-fluoro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.