![3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid structure](/static/products/4000/400086-47-7.webp)
3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid
TL;DR: 3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid (CAS 400086-47-7) is a chemical compound with molecular formula C14H12N2O4S and molecular weight 304.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-benzamidoacetyl)amino]thiophene-2-carboxylic acid
Also Known As: 3-[(2-benzamidoacetyl)amino]thiophene-2-carboxylic Acid, 3-{[2-(benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid, 3-[2-(phenylformamido)acetamido]thiophene-2-carboxylic acid, 3-[2-(phenylformamido)acetamido]thiophene-2-carboxylicacid
| Molecular Formula | C14H12N2O4S |
|---|---|
| Molecular Weight | 304.05 g/mol |
| LogP | 1.8148 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.0518 |
| Heavy Atoms | 21 |
| Complexity | 666.62335 |
Chemical Identifiers
| CAS Number | 400086-47-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NCC(=O)NC2=C(SC=C2)C(=O)O |
Product Overview
3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid (CAS 400086-47-7), with molecular formula C14H12N2O4S and molecular weight 304.05 g/mol. IUPAC: 3-[(2-benzamidoacetyl)amino]thiophene-2-carboxylic acid.
Chemical Property Profile of 3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid
Property Insights of 3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid
The XLogP value of 1.8148 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid. Following Lipinski's Rule of Five, 3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic 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-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid?
The CAS number of 3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid is 400086-47-7.
What is the molecular formula of 3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid?
The molecular formula of 3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid is C14H12N2O4S.
What is the molecular weight of 3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid?
The molecular weight of 3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid is 304.05 g/mol.
Where can I buy 3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid?
You can request a quote for 3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-{[2-(Benzoylamino)acetyl]amino}-2-thiophenecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.