![4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid structure](/static/products/370/370573-11-8.png)
4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid
TL;DR: 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid (CAS 370573-11-8) is a chemical compound with molecular formula C15H12N2O3S2 and molecular weight 332.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid
Also Known As: 4-[3-((E)-3-Thiophen-2-yl-acryloyl)-thioureido]-benzoic acid, 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid, (E)-4-(3-(3-(thiophen-2-yl)acryloyl)thioureido)benzoic acid, 4-(3-thiophen-2-ylprop-2-enoylthiocarbamoylamino)benzoic Acid, 4-[[(E)-3-(2-thienyl)acryloyl]thiocarbamoylamino]benzoic acid
| Molecular Formula | C15H12N2O3S2 |
|---|---|
| Molecular Weight | 332.03 g/mol |
| LogP | 2.9727 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 332.02893 |
| Heavy Atoms | 22 |
| Complexity | 706.8986 |
Chemical Identifiers
| CAS Number | 370573-11-8 |
|---|---|
| SMILES | C1=CSC(=C1)/C=C/C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)O |
Product Overview
4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid (CAS 370573-11-8), with molecular formula C15H12N2O3S2 and molecular weight 332.03 g/mol. IUPAC: 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid.
Chemical Property Profile of 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid
Property Insights of 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid
The XLogP value of 2.9727 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid. Following Lipinski's Rule of Five, 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]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 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid?
The CAS number of 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid is 370573-11-8.
What is the molecular formula of 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid?
The molecular formula of 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid is C15H12N2O3S2.
What is the molecular weight of 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid?
The molecular weight of 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid is 332.03 g/mol.
Where can I buy 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid?
You can request a quote for 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]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 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.