![4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide structure](/static/products/6978/6978-15-0.webp)
4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide
TL;DR: 4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide (CAS 6978-15-0) is a chemical compound with molecular formula C14H9ClFN3O3S and molecular weight 353.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide
Also Known As: 4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide, 4-chloro-N-[(4-fluorophenyl)thiocarbamoyl]-3-nitro-benzamide
| Molecular Formula | C14H9ClFN3O3S |
|---|---|
| Molecular Weight | 353.00 g/mol |
| LogP | 3.5141 |
| Topological Polar Surface Area | 84.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 353.00372 |
| Heavy Atoms | 23 |
| Complexity | 783.337 |
Chemical Identifiers
| CAS Number | 6978-15-0 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=S)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])F |
Product Overview
4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide (CAS 6978-15-0), with molecular formula C14H9ClFN3O3S and molecular weight 353.00 g/mol. IUPAC: 4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide.
Chemical Property Profile of 4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide
Property Insights of 4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide
The XLogP value of 3.5141 indicates that 4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide. Following Lipinski's Rule of Five, 4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide has 2 hydrogen bond donor(s) and 4 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-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide?
The CAS number of 4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide is 6978-15-0.
What is the molecular formula of 4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide?
The molecular formula of 4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide is C14H9ClFN3O3S.
What is the molecular weight of 4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide?
The molecular weight of 4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide is 353.00 g/mol.
Where can I buy 4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide?
You can request a quote for 4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-[(4-fluorophenyl)carbamothioyl]-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.