![3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid structure](/static/products/5329/532979-50-3.webp)
3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid
TL;DR: 3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid (CAS 532979-50-3) is a chemical compound with molecular formula C19H12Br2N2O3S and molecular weight 505.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dibromo-2-(naphthalene-1-carbonylcarbamothioylamino)benzoic acid
Also Known As: 3,5-dibromo-2-(naphthalene-1-carbonylcarbamothioylamino)benzoic acid, 3,5-dibromo-2-(naphthalene-1-carbonylthiocarbamoylamino)benzoic Acid, 3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl ]amino]-benzoic acid
| Molecular Formula | C19H12Br2N2O3S |
|---|---|
| Molecular Weight | 505.89 g/mol |
| LogP | 5.1898 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 505.89355 |
| Heavy Atoms | 27 |
| Complexity | 1080.4879 |
Chemical Identifiers
| CAS Number | 532979-50-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2C(=O)NC(=S)NC3=C(C=C(C=C3Br)Br)C(=O)O |
Product Overview
3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid (CAS 532979-50-3), with molecular formula C19H12Br2N2O3S and molecular weight 505.89 g/mol. IUPAC: 3,5-dibromo-2-(naphthalene-1-carbonylcarbamothioylamino)benzoic acid.
Chemical Property Profile of 3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid
Property Insights of 3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid
The XLogP value of 5.1898 indicates that 3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid. Following Lipinski's Rule of Five, 3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid?
The CAS number of 3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid is 532979-50-3.
What is the molecular formula of 3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid?
The molecular formula of 3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid is C19H12Br2N2O3S.
What is the molecular weight of 3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid?
The molecular weight of 3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid is 505.89 g/mol.
Where can I buy 3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid?
You can request a quote for 3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dibromo-2-[[[(1-naphthalenylcarbonyl)amino]thioxomethyl]amino]-benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.