![N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide structure](/static/products/4620/462061-85-4.webp)
N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide
TL;DR: N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide (CAS 462061-85-4) is a chemical compound with molecular formula C22H17ClFN3O3S and molecular weight 457.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide
Also Known As: 2-chloro-N-[4-({[(2-fluorophenyl)carbonyl]carbamothioyl}amino)-2-methoxyphenyl]benzamide, N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide, 2-chloro-N-[4-[(2-fluorobenzoyl)thiocarbamoylamino]-2-methoxy-phenyl]benzamide
| Molecular Formula | C22H17ClFN3O3S |
|---|---|
| Molecular Weight | 457.07 g/mol |
| LogP | 4.8668 |
| Topological Polar Surface Area | 79.46 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 457.0663 |
| Heavy Atoms | 31 |
| Complexity | 1156.35 |
Chemical Identifiers
| CAS Number | 462061-85-4 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=CC=C2F)NC(=O)C3=CC=CC=C3Cl |
Product Overview
N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide (CAS 462061-85-4), with molecular formula C22H17ClFN3O3S and molecular weight 457.07 g/mol. IUPAC: N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide.
Chemical Property Profile of N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide
Property Insights of N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide
The XLogP value of 4.8668 indicates that N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.46 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide. Following Lipinski's Rule of Five, N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide has 3 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-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide?
The CAS number of N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide is 462061-85-4.
What is the molecular formula of N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide?
The molecular formula of N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide is C22H17ClFN3O3S.
What is the molecular weight of N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide?
The molecular weight of N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide is 457.07 g/mol.
Where can I buy N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide?
You can request a quote for N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-2-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.