![2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid structure](/static/products/903/903584-33-8.png)
2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid
TL;DR: 2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid (CAS 903584-33-8) is a chemical compound with molecular formula C19H20N2O4S and molecular weight 372.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-oxo-2-(2-phenylethylamino)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
Also Known As: 2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid, 2-({oxo[(2-phenylethyl)amino]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid, 2-(2-oxo-2-(phenethylamino)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid, 2-[[2-oxo-2-(phenethylamino)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
| Molecular Formula | C19H20N2O4S |
|---|---|
| Molecular Weight | 372.11 g/mol |
| LogP | 2.6225 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 372.11438 |
| Heavy Atoms | 26 |
| Complexity | 829.5647 |
Chemical Identifiers
| CAS Number | 903584-33-8 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C(=O)NCCC3=CC=CC=C3)C(=O)O |
Product Overview
2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid (CAS 903584-33-8), with molecular formula C19H20N2O4S and molecular weight 372.11 g/mol. IUPAC: 2-[[2-oxo-2-(2-phenylethylamino)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid.
Chemical Property Profile of 2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid
Property Insights of 2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid
The XLogP value of 2.6225 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid. Following Lipinski's Rule of Five, 2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic 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 2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid?
The CAS number of 2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid is 903584-33-8.
What is the molecular formula of 2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid?
The molecular formula of 2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid is C19H20N2O4S.
What is the molecular weight of 2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid?
The molecular weight of 2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid is 372.11 g/mol.
Where can I buy 2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid?
You can request a quote for 2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(phenethylcarbamoylformyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.