![3-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid structure](/static/products/370/370573-58-3.png)
3-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid
TL;DR: 3-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid (CAS 370573-58-3) 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.
3-(thiophene-2-carbonylcarbamothioylamino)benzoic acid
Also Known As: 3-(3-(thiophene-2-carbonyl)thioureido)benzoic acid, 3-(thiophene-2-carbonylcarbamothioylamino)benzoic acid, 3-(thiophene-2-carbonylthiocarbamoylamino)benzoic Acid, 3-{[(thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid, 3-({[(2-THIENYLCARBONYL)AMINO]CARBOTHIOYL}AMINO)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 | 653.3957 |
Chemical Identifiers
| CAS Number | 370573-58-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=S)NC(=O)C2=CC=CS2)C(=O)O |
Product Overview
3-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid (CAS 370573-58-3), with molecular formula C13H10N2O3S2 and molecular weight 306.01 g/mol. IUPAC: 3-(thiophene-2-carbonylcarbamothioylamino)benzoic acid.
Chemical Property Profile of 3-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid
Property Insights of 3-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid
The XLogP value of 2.5731 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid. Following Lipinski's Rule of Five, 3-{[(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 3-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid?
The CAS number of 3-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid is 370573-58-3.
What is the molecular formula of 3-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid?
The molecular formula of 3-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid is C13H10N2O3S2.
What is the molecular weight of 3-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid?
The molecular weight of 3-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid is 306.01 g/mol.
Where can I buy 3-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid?
You can request a quote for 3-{[(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 3-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-{[(Thiophen-2-ylcarbonyl)carbamothioyl]amino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.