3-Fluorothiobenzamide
TL;DR: 3-Fluorothiobenzamide (CAS 72505-20-5) is a chemical compound with molecular formula C7H6FNS and molecular weight 155.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-fluorobenzenecarbothioamide
Also Known As: 3-Fluorothiobenzamide, 3-FLUOROBENZOTHIOAMIDE, 3-fluorobenzenecarbothioamide, 3-FLUOROBENZENE-1-CARBOTHIOAMIDE, Benzenecarbothioamide,3-fluoro-
| Molecular Formula | C7H6FNS |
|---|---|
| Molecular Weight | 155.02 g/mol |
| LogP | 1.4599 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 155.0205 |
| Heavy Atoms | 10 |
| Complexity | 259.53796 |
Chemical Identifiers
| CAS Number | 72505-20-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)C(=S)N |
Product Overview
3-Fluorothiobenzamide (CAS 72505-20-5), with molecular formula C7H6FNS and molecular weight 155.02 g/mol. IUPAC: 3-fluorobenzenecarbothioamide.
Chemical Property Profile of 3-Fluorothiobenzamide
Property Insights of 3-Fluorothiobenzamide
The XLogP value of 1.4599 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Fluorothiobenzamide. With a topological polar surface area (TPSA) of 26.02 Ų, 3-Fluorothiobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Fluorothiobenzamide has 1 hydrogen bond donor(s) and 1 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 3-Fluorothiobenzamide?
The CAS number of 3-Fluorothiobenzamide is 72505-20-5.
What is the molecular formula of 3-Fluorothiobenzamide?
The molecular formula of 3-Fluorothiobenzamide is C7H6FNS.
What is the molecular weight of 3-Fluorothiobenzamide?
The molecular weight of 3-Fluorothiobenzamide is 155.02 g/mol.
Where can I buy 3-Fluorothiobenzamide?
You can request a quote for 3-Fluorothiobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Fluorothiobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Fluorothiobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.