![[(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate structure](/static/products/876/876536-22-0.png)
[(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate
TL;DR: [(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate (CAS 876536-22-0) is a chemical compound with molecular formula C16H17NO3S and molecular weight 303.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(2-phenylethylamino)ethyl] 5-methylthiophene-2-carboxylate
Also Known As: [(2-phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate|F6609-4167|2-oxo-2-(phenethylamino)ethyl 5-methylthiophene-2-carboxylate|[2-oxo-2-(2-phenylethylamino)ethyl] 5-methylthiophene-2-carboxylate|[2-oxo-2-(phenethylamino)ethyl] 5-methylthiophene-2-carboxylate|2-oxo-2-[(2-phenylethyl)amino]ethyl 5-methylthiophene-2-carboxylate
| Molecular Formula | C16H17NO3S |
|---|---|
| Molecular Weight | 303.09 g/mol |
| LogP | 2.57222 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 303.09293 |
| Heavy Atoms | 21 |
| Complexity | 606.99445 |
Chemical Identifiers
| CAS Number | 876536-22-0 |
|---|---|
| SMILES | CC1=CC=C(S1)C(=O)OCC(=O)NCCC2=CC=CC=C2 |
Product Overview
[(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate (CAS 876536-22-0), with molecular formula C16H17NO3S and molecular weight 303.09 g/mol. IUPAC: [2-oxo-2-(2-phenylethylamino)ethyl] 5-methylthiophene-2-carboxylate.
Chemical Property Profile of [(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate
Property Insights of [(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate
The XLogP value of 2.57222 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate. With a topological polar surface area (TPSA) of 55.4 Ų, [(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate has 1 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-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate?
The CAS number of [(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate is 876536-22-0.
What is the molecular formula of [(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate?
The molecular formula of [(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate is C16H17NO3S.
What is the molecular weight of [(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate?
The molecular weight of [(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate is 303.09 g/mol.
Where can I buy [(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate?
You can request a quote for [(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [(2-Phenylethyl)carbamoyl]methyl 5-methylthiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.