![N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide structure](/static/products/4284/428498-08-2.webp)
N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide
TL;DR: N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide (CAS 428498-08-2) is a chemical compound with molecular formula C14H10FN3O3S and molecular weight 319.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide
Also Known As: N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide
| Molecular Formula | C14H10FN3O3S |
|---|---|
| Molecular Weight | 319.04 g/mol |
| LogP | 2.8607 |
| Topological Polar Surface Area | 84.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 319.0427 |
| Heavy Atoms | 22 |
| Complexity | 751.61786 |
Chemical Identifiers
| CAS Number | 428498-08-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC(=S)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])F |
Product Overview
N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide (CAS 428498-08-2), with molecular formula C14H10FN3O3S and molecular weight 319.04 g/mol. IUPAC: N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide.
Chemical Property Profile of N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide
Property Insights of N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide
The XLogP value of 2.8607 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide. The TPSA of 84.27 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide. Following Lipinski's Rule of Five, N-[(2-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 N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide?
The CAS number of N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide is 428498-08-2.
What is the molecular formula of N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide?
The molecular formula of N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide is C14H10FN3O3S.
What is the molecular weight of N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide?
The molecular weight of N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide is 319.04 g/mol.
Where can I buy N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide?
You can request a quote for N-[(2-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 N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-fluorophenyl)carbamothioyl]-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.