![4-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid structure](/static/products/3705/370574-94-0.webp)
4-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid
TL;DR: 4-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid (CAS 370574-94-0) is a chemical compound with molecular formula C13H10N2O3S2 and molecular weight 306.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(thiophene-2-carbonylcarbamothioylamino)benzoic acid
Also Known As: BAS 03155043, 4-{[(thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid, AB00120078-01, 4-(3-(thiophene-2-carbonyl)thioureido)benzoic acid, 4-(thiophene-2-carbonylcarbamothioylamino)benzoic acid
| Molecular Formula | C13H10N2O3S2 |
|---|---|
| Molecular Weight | 306.01 g/mol |
| LogP | 2.5731 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 306.01328 |
| Heavy Atoms | 20 |
| Complexity | 636.1457 |
Chemical Identifiers
| CAS Number | 370574-94-0 |
|---|---|
| SMILES | C1=CSC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)O |
Product Overview
4-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid (CAS 370574-94-0), with molecular formula C13H10N2O3S2 and molecular weight 306.01 g/mol. IUPAC: 4-(thiophene-2-carbonylcarbamothioylamino)benzoic acid.
Chemical Property Profile of 4-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid
Property Insights of 4-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid
The XLogP value of 2.5731 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid. Following Lipinski's Rule of Five, 4-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}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-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid?
The CAS number of 4-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid is 370574-94-0.
What is the molecular formula of 4-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid?
The molecular formula of 4-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid is C13H10N2O3S2.
What is the molecular weight of 4-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid?
The molecular weight of 4-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid is 306.01 g/mol.
Where can I buy 4-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid?
You can request a quote for 4-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}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-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.