![4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide structure](/static/products/4284/428457-99-2.webp)
4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide
TL;DR: 4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide (CAS 428457-99-2) is a chemical compound with molecular formula C14H12FN3OS and molecular weight 289.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-fluoro-N-[(3-methyl-2-pyridinyl)carbamothioyl]benzamide
Also Known As: 4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide
| Molecular Formula | C14H12FN3OS |
|---|---|
| Molecular Weight | 289.07 g/mol |
| LogP | 2.65592 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.0685 |
| Heavy Atoms | 20 |
| Complexity | 643.1222 |
Chemical Identifiers
| CAS Number | 428457-99-2 |
|---|---|
| SMILES | CC1=C(N=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)F |
Product Overview
4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide (CAS 428457-99-2), with molecular formula C14H12FN3OS and molecular weight 289.07 g/mol. IUPAC: 4-fluoro-N-[(3-methyl-2-pyridinyl)carbamothioyl]benzamide.
Chemical Property Profile of 4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide
Property Insights of 4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide
The XLogP value of 2.65592 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide. With a topological polar surface area (TPSA) of 54.02 Ų, 4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide 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 4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide?
The CAS number of 4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide is 428457-99-2.
What is the molecular formula of 4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide?
The molecular formula of 4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide is C14H12FN3OS.
What is the molecular weight of 4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide?
The molecular weight of 4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide is 289.07 g/mol.
Where can I buy 4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide?
You can request a quote for 4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-fluoro-N-[(3-methylpyridin-2-yl)carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.