![3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid structure](/static/products/5315/531540-31-5.webp)
3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid
TL;DR: 3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid (CAS 531540-31-5) is a chemical compound with molecular formula C15H7Br3I2N2O3S and molecular weight 785.5817 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,5-dibromo-2-[(2-bromo-3,5-diiodobenzoyl)carbamothioylamino]benzoic acid
Also Known As: 3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid, 3,5-dibromo-2-[(2-bromo-3,5-diiodobenzoyl)carbamothioylamino]benzoic acid, 3,5-Dibromo-2-[[[(2-bromo-3,5-diiodobenzoyl)amino]thioxomethyl ]amino]-benzoic acid
Technical Specifications
| Molecular Formula | C15H7Br3I2N2O3S |
| Molecular Weight | 785.5817 g/mol |
| XLogP | 6.4 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 785.5817 Da |
| Heavy Atoms | 26 |
| Complexity | 574.0 |
| SMILES | C1=C(C=C(C(=C1C(=O)O)NC(=S)NC(=O)C2=C(C(=CC(=C2)I)I)Br)Br)Br |
| InChIKey | HXOJHYQJLJVCMN-UHFFFAOYSA-N |
Chemical Property Profile of 3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid
Property Insights of 3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid
The XLogP value of 6.4 indicates that 3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid. Following Lipinski's Rule of Five, 3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid?
The CAS number of 3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid is 531540-31-5.
What is the molecular formula of 3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid?
The molecular formula of 3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid is C15H7Br3I2N2O3S.
What is the molecular weight of 3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid?
The molecular weight of 3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid is 785.5817 g/mol.
Where can I buy 3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid?
You can request a quote for 3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid?
Yes, CoreyChem provides custom synthesis services for 3,5-dibromo-2-[(2-bromo-3,5-diiodo-benzoyl)thiocarbamoylamino]benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.