![3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic Acid structure](/static/products/5324/532422-41-6.webp)
3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic Acid
TL;DR: 3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic Acid (CAS 532422-41-6) is a chemical compound with molecular formula C15H10Cl2N2O4S and molecular weight 383.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dichloro-2-[3-(furan-2-yl)prop-2-enoylcarbamothioylamino]benzoic acid
Also Known As: 3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic Acid, 3,5-dichloro-2-[3-(furan-2-yl)prop-2-enoylcarbamothioylamino]benzoic acid, 3,5-Dichloro-2-[[[[3-(2-furanyl)-1-oxo-2-propenyl ]amino]thioxomethyl ]amino]-benzoic acid
| Molecular Formula | C15H10Cl2N2O4S |
|---|---|
| Molecular Weight | 383.97 g/mol |
| LogP | 3.811 |
| Topological Polar Surface Area | 91.57 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.97385 |
| Heavy Atoms | 24 |
| Complexity | 819.1316 |
Chemical Identifiers
| CAS Number | 532422-41-6 |
|---|---|
| SMILES | C1=COC(=C1)C=CC(=O)NC(=S)NC2=C(C=C(C=C2Cl)Cl)C(=O)O |
Product Overview
3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic Acid (CAS 532422-41-6), with molecular formula C15H10Cl2N2O4S and molecular weight 383.97 g/mol. IUPAC: 3,5-dichloro-2-[3-(furan-2-yl)prop-2-enoylcarbamothioylamino]benzoic acid.
Chemical Property Profile of 3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic Acid
Property Insights of 3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic Acid
The XLogP value of 3.811 indicates that 3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic 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 3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic Acid. Following Lipinski's Rule of Five, 3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]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-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic Acid?
The CAS number of 3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic Acid is 532422-41-6.
What is the molecular formula of 3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic Acid?
The molecular formula of 3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic Acid is C15H10Cl2N2O4S.
What is the molecular weight of 3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic Acid?
The molecular weight of 3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic Acid is 383.97 g/mol.
Where can I buy 3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic Acid?
You can request a quote for 3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]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-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3,5-dichloro-2-[3-(2-furyl)prop-2-enoylthiocarbamoylamino]benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.