![Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo- structure](/static/products/5315/531529-74-5.webp)
Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo-
TL;DR: Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo- (CAS 531529-74-5) is a chemical compound with molecular formula C17H14I2N2O4S and molecular weight 595.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-ethoxybenzoyl)carbamothioylamino]-3,5-diiodobenzoic acid
Also Known As: 2-[(4-ethoxybenzoyl)carbamothioylamino]-3,5-diiodobenzoic acid, Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo-, 2-[(4-ethoxybenzoyl)thiocarbamoylamino]-3,5-diiodo-benzoic Acid, 2-{[(4-Ethoxybenzoyl)carbamothioyl]amino}-3,5-diiodobenzoic acid, 2-[[[(4-Ethoxybenzoyl)amino]thioxomethyl ]amino]-3,5-diiodo-benzoic acid
| Molecular Formula | C17H14I2N2O4S |
|---|---|
| Molecular Weight | 595.88 g/mol |
| LogP | 4.1195 |
| Topological Polar Surface Area | 87.66 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 595.87634 |
| Heavy Atoms | 26 |
| Complexity | 856.58655 |
Chemical Identifiers
| CAS Number | 531529-74-5 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2I)I)C(=O)O |
Product Overview
Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo- (CAS 531529-74-5), with molecular formula C17H14I2N2O4S and molecular weight 595.88 g/mol. IUPAC: 2-[(4-ethoxybenzoyl)carbamothioylamino]-3,5-diiodobenzoic acid.
Chemical Property Profile of Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo-
Property Insights of Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo-
The XLogP value of 4.1195 indicates that Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.66 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo-. Following Lipinski's Rule of Five, Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo- 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 Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo-?
The CAS number of Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo- is 531529-74-5.
What is the molecular formula of Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo-?
The molecular formula of Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo- is C17H14I2N2O4S.
What is the molecular weight of Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo-?
The molecular weight of Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo- is 595.88 g/mol.
Where can I buy Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo-?
You can request a quote for Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-[[[(4-ethoxybenzoyl)amino]thioxomethyl]amino]-3,5-diiodo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.