![2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid structure](/static/products/5359/535940-86-4.webp)
2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid
TL;DR: 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid (CAS 535940-86-4) is a chemical compound with molecular formula C19H11BrCl2N2O4S and molecular weight 511.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid
Also Known As: 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid, 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,, 2-({[5-(4-Bromophenyl)furan-2-carbonyl]carbamothioyl}amino)-3,5-dichlorobenzoic acid, 2-[[5-(4-bromophenyl)furan-2-carbonyl]thiocarbamoylamino]-3,5-dichloro-benzoic Acid
| Molecular Formula | C19H11BrCl2N2O4S |
|---|---|
| Molecular Weight | 511.90 g/mol |
| LogP | 5.8409 |
| Topological Polar Surface Area | 91.57 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 511.9 |
| Heavy Atoms | 29 |
| Complexity | 1115.897 |
Chemical Identifiers
| CAS Number | 535940-86-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CC=C(O2)C(=O)NC(=S)NC3=C(C=C(C=C3Cl)Cl)C(=O)O)Br |
Product Overview
2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid (CAS 535940-86-4), with molecular formula C19H11BrCl2N2O4S and molecular weight 511.90 g/mol. IUPAC: 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid.
Chemical Property Profile of 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid
Property Insights of 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid
The XLogP value of 5.8409 indicates that 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.57 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid. Following Lipinski's Rule of Five, 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid?
The CAS number of 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid is 535940-86-4.
What is the molecular formula of 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid?
The molecular formula of 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid is C19H11BrCl2N2O4S.
What is the molecular weight of 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid?
The molecular weight of 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid is 511.90 g/mol.
Where can I buy 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid?
You can request a quote for 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[[5-(4-bromophenyl)furan-2-carbonyl]carbamothioylamino]-3,5-dichlorobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.