![3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid structure](/static/products/5339/533919-33-4.webp)
3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid
TL;DR: 3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid (CAS 533919-33-4) is a chemical compound with molecular formula C19H18Cl2N2O4S and molecular weight 440.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid
Also Known As: 3,5-dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid, 3,5-Dichloro-2-({[4-(2-methylpropoxy)benzoyl]carbamothioyl}amino)benzoic acid, 3,5-dichloro-2-[[4-(2-methylpropoxy)benzoyl]thiocarbamoylamino]benzoic Acid, 3,5-DICHLORO-2-[[[[4-(2-METHYLPROPOXY)BENZOYL ]AMINO]THIOXOMETHYL ]AMINO]-BENZOIC ACID
| Molecular Formula | C19H18Cl2N2O4S |
|---|---|
| Molecular Weight | 440.04 g/mol |
| LogP | 4.8532 |
| Topological Polar Surface Area | 87.66 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 440.03644 |
| Heavy Atoms | 28 |
| Complexity | 901.5518 |
Chemical Identifiers
| CAS Number | 533919-33-4 |
|---|---|
| SMILES | CC(C)COC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2Cl)Cl)C(=O)O |
Product Overview
3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid (CAS 533919-33-4), with molecular formula C19H18Cl2N2O4S and molecular weight 440.04 g/mol. IUPAC: 3,5-dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid.
Chemical Property Profile of 3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid
Property Insights of 3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid
The XLogP value of 4.8532 indicates that 3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid 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 3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid. Following Lipinski's Rule of Five, 3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid 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 3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid?
The CAS number of 3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid is 533919-33-4.
What is the molecular formula of 3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid?
The molecular formula of 3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid is C19H18Cl2N2O4S.
What is the molecular weight of 3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid?
The molecular weight of 3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid is 440.04 g/mol.
Where can I buy 3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid?
You can request a quote for 3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]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-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dichloro-2-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.