4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide
TL;DR: 4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide (CAS 364597-79-5) is a chemical compound with molecular formula C18H19FN2OS and molecular weight 330.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide
Also Known As: AB00109219-01, 4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide, 1-(4-tert-Butyl-benzoyl)-3-(2-fluoro-phenyl)-thiourea, 4-tert-butyl-N-{[(2-fluorophenyl)amino]carbonothioyl}benzamide
| Molecular Formula | C18H19FN2OS |
|---|---|
| Molecular Weight | 330.12 g/mol |
| LogP | 4.25 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 330.1202 |
| Heavy Atoms | 23 |
| Complexity | 720.5466 |
Chemical Identifiers
| CAS Number | 364597-79-5 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2F |
Product Overview
4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide (CAS 364597-79-5), with molecular formula C18H19FN2OS and molecular weight 330.12 g/mol. IUPAC: 4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide.
Chemical Property Profile of 4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide
Property Insights of 4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide
The XLogP value of 4.25 indicates that 4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, 4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide 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 4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide?
The CAS number of 4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide is 364597-79-5.
What is the molecular formula of 4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide?
The molecular formula of 4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide is C18H19FN2OS.
What is the molecular weight of 4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide?
The molecular weight of 4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide is 330.12 g/mol.
Where can I buy 4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide?
You can request a quote for 4-tert-butyl-N-[(2-fluorophenyl)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-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-tert-butyl-N-[(2-fluorophenyl)carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.